|
H.-W. Moon, N. Noethling, M. Leutzsch, J. Kuziola, J. Cornella |
Characterization of Iminobismuthanes and Catalytic Reduction of Organic Azides via Bi(I)/Bi(III) Redox Cycling |
Angew. Chem. Int. Ed. 64 (2025) e202417864 |
|
Research Area: II
|
|
S. Webb, A. Veliju, P. Maroni, U.-P. Apfel, T. Happe, R. D. Milton |
Mesoporous Electrodes Enhance the Electrocatalytic Performance of [FeFe]-Hydrogenase |
Angew. Chem. Int. Ed. 64 (2025) e202416658 |
|
Research Area: II
|
|
S. Tsuru, B. Sharma, C. Haettig, D. Marx |
Nuclear Quantum Effects Have a Significant Impact on UV/Vis Absorption Spectra of Chromophores in Water |
Angew. Chem. Int. Ed. 64 (2025) e202416058 |
|
Research Area: I
|
|
J. Kim, M. Usama, K. S. Exner, S. Hoon Joo |
Renaissance of Chlorine Evolution Reaction: Emerging Theory and Catalytic Materials |
Angew. Chem. Int. Ed. 64 (2025) e202417293 |
|
Research Area: II
|
|
K. E. Ebbert, F. Sendzik, L. Neukirch, L. Eberlein, A. Platzek, P. Kibies, S. M. Kast, G. H. Clever |
Solvent-Controlled Separation of Integratively Self-Sorted Pd2LA2LB2 Coordination Cages |
Angew. Chem. Int. Ed. 64 (2025) e202416076 |
|
Research Area: II
|
|
A. Durmisevic, I. Regeni, M. E. Namoro, A. Baksi, G. H. Clever |
Phenazinium- and Malachite Green-Based Pd(II) Cages: Chiroptical Discrimination of Nucleoside Triphosphates |
Chem. Eur. J. 31 (2025) e202403679 |
|
Research Area: II
|
|
M. Zaeh, C. Brandenbusch, F. Artusio, G. Sadowski, R. Pisano |
DSC reveals the excipient impact on aggregation propensity of pharmaceutical peptides during freezing |
Eur. J. Pharm. Sci. 204 (2025) 106954 |
|
Research Area: III
|
|
X. Li, F. S. Brigiano, S. Pezzotti, X. Liu, W. Chen, H. Chen, Y. Li, X. Lin, W. Zheng, Y. Wang Y. R. Shen, M.-P. Gaigeot, W. -T. Liu |
Unconventional structural evolution of an oxide surface in water unveiled by in situ sum-frequency spectroscopy |
Nat. Chem. 17 (2025) 198-203 |
|
Research Area: I
|
|
L. Kelling, V. K. Gessner |
Coordination chemistry of a weakly coordinating carbanion |
Polyhedron 265 (2025) 117283 |
|
Research Area: II
|
|
Y. Kong, J. Riebe, M. Fessner, T. Schaller, C. Woelper, F. Stappert, S. W. Meckelmann, M. Krajnc, P. Weyrauch, O. J. Schmitz, C. Merten, J. Niemeyer, X. Hu, R. U. Meckenstock |
A CoA-Transferase and Acyl-CoA Dehydrogenase Convert 2-(Carboxymethyl)cyclohexane-1-Carboxyl-CoA During Anaerobic Naphthalene Degradation |
Environ. Microbiol. 26 (2025) e70013 |
|
Research Area: II
|
|
H. Aucharova, R. Linser |
Assignment of the N-terminal domain of mouse cGAS |
Biomol. NMR Assign. - (2025) - |
|
Research Area: I
|
|
I. A. Medvedkov, Z. Yang, A. A. Nikolayev, S. J. Goetti, A. K. Eckhardt, A. M. Mebel, R. I. Kaiser |
Binding the Power of Cycloaddition and Cross-Coupling in a Single Mechanism: An Unexpected Bending Journey to Radical Chemistry of Butadiynyl with Conjugated Dienes |
J. Phys. Chem. Lett. 16 (2025) 658-666 |
|
Research Area: II
|
|
T. J. Shaldehi, S. Rowshanzamir, K. S. Exner, F. Vines, F. Illas |
Conventional versus Unconventional Oxygen Reduction Reaction Intermediates on Single Atom Catalysts |
ACS Appl. Mater. Interfaces 17 (2025) 6450-6459 |
|
Research Area: II
|
|
T. Wu, K. Dhaka, M. Luo, B. Wang, M. Wang, S. Xi, M. Zhang, F. Huang, K. S. Exner, Y. Lum |
Cooperative Active Sites on Ag2Pt3TiS6 for Enhanced Low-Temperature Ammonia Fuel Cell Electrocatalysis |
Angew. Chem. Int. Ed. 64 (2025) e202418691 |
|
Research Area: I
|
|
M. Usama, S. Razzaq, K. S. Exner |
Design Criteria for Active and Selective Catalysts in the Nitrogen Oxidation Reaction |
ACS Phys. Chem Au 5 (2025) 38-46 |
|
Research Area: II
|
|
T. A. Said, D. Spinnato, K. Holldack, F. Neese, J. Cornella, A. Schnegg |
Direct Determination of a Giant Zero-Field Splitting of 5422 cm-1 in a Triplet Organobismuthinidene by Infrared Electron Paramagnetic Resonance |
J. Am. Chem. Soc. 147 (2025) 84-87 |
|
Research Area: II
|
|
J. Buchholz, E. K. Oehl, M. M Hielscher, S. L. Kuhn, D. Schollmeyer, S. R. Waldvogel |
Electrochemical Dehydrogenative sp2-Coupling Reaction of Naphthols Accessing a Polycyclic Naphthalenone Motif |
Org. Lett. 27 (2025) 25-29 |
|
Research Area: II
|
|
E. Benchimol, A. Rivoli, M. Kabiri, B. Zhang, J. J. Holstein, P. Ballester, G. H. Clever |
Guest Segregation in Heteromeric Multicage Systems |
J. Am. Chem. Soc. 147 (2025) 3823-3829 |
|
Research Area: II
|
|
D. Knyszek, J. Loeffler, D. E. Anderson, E. Hevia, V. H. Gessner |
Harnessing Organopotassium Reagents for Cross-Coupling with YPhos-Pd Catalysts: Opportunities, Applications, and Challenges |
J. Am. Chem. Soc. 147 (2025) 5417-5425 |
|
Research Area: II
|
|
F. Novelli, A. Buchmann, I. Yousaf, L.-L. Stiewe, W. Bronsch, F. Cilento, C. Hoberg, M. Havenith |
High-Mobility Electrons in Aqueous Iodide Solutions |
ACS Omega 10 (2025) 5097-5104 |
|
Research Area: I
|
|
J. T. Metternich, S. K. Patjoshi, T. Kiswal, S. Kruss |
High-Throughput Approaches to Engineer Fluorescent Nanosensors |
Adv. Mat. 37 (2025) 2411067 |
|
Research Area: III
|
|
H. G. Daronkola, B. Moussa, O. Millet, O. Krenczyk, G. Ortega-Quintanilla, P. B. Petersen, A. Vila Verde |
How sensitive are protein hydration shells to electrolyte concentration and protein composition? |
Protein Sci. 34 (2025) e5241 |
|
Research Area: I
|
|
P. Hosseini, A. Rodriguez-Camargo, L. Yao, B. V. Lotsch, K. Tschulik |
Identifying the active species in a cobalt-based covalent organic framework for the electrochemical oxygen evolution reaction |
Adv. Sci. 12 (2025) 2413555 |
|
Research Area: I
|
|
I. Weber, C. Penschke, A. Michaelides, K. Morgenstern |
Importance of Ion Size on the Dominance of Water-Ion Versus Water-Water Interactions in Au-Supported Solvatomers |
Nano Lett. 25 (2025) 2188-2194 |
|
Research Area: I
|
|
Z. Yin, M. Zhang, Y. Long, H. Lei, X. Li, X. -P. Zhang, W. Zhang, U.-P. Apfel, R. Cao |
Improving Electrocatalytic CO2 Reduction over Iron Tetraphenylporphyrin with Triethanolamine as a CO2 Shuttle |
Angew. Chem. Int. Ed. (2025) e202500154 |
|
Research Area: II
|
|
A. Omarnpour, J. Elsner, K. N. Lausch, J. Behler |
Machine Learning Potentials for Heterogeneous Catalysis |
ACS. Catal. 15 (2025) 1616-1634 |
|
Research Area: II
|
|
N. Stolte, J. Daru, H. Forbert, J. Behler, D. Marx |
Nuclear Quantum Effects in Liquid Water are Negligible for Structure but Significant for Dynamics |
J. Phys. Chem. Lett. 15 (2025) 12144-12150 |
|
Research Area: I
|
|
C. A. Schrage, P. Galonska, J. T. Metternich, S. Kruss |
Photophysical Properties of Tandem Quantum Defects in Carbon Nanotubes |
J. Phys. Chem. Lett. 16 (2025) 1573-1581 |
|
Research Area: I
|
|
F. Kuehne, J. Patwari, N. Osterloh, A. Sugai, K. Morgenstern, U. Bovensiepen |
Real-Time Observation of Ion-Solvent Interaction at the D2O/Na+/Cu(111) Interface: Insights into Dynamics and Structure |
J. Phys. Chem. C 129 (2025) 2054-2061 |
|
Research Area: I
|
|
P. Hosseini, A. R. Camargo, Y. Jiang, S. Zhang, C. Scheu, L. Yao, B. V. Lotsch, K. Tschulik |
Shedding Light on the Active Species in a Cobalt-Based Covalent Organic Framework for the Electrochemical Oxygen Evolution Reaction |
Adv. Sci. 12 (2025) 2413555 |
|
Research Area: I
|
|
J. Duan, A. Rutz, A. Kawamoto, S. Naskar, K. Edenharter, S. Leimkuehler, E. Hofmann, T. Happe, G. Kurisu |
Structural determinants of oxygen resistance and Zn2+-mediated stability of the [FeFe]-hydrogenase from Clostridium beijerinckii |
PNAS 122 (2025) e2416233122 |
|
Research Area: II
|
|
J. Wolf, F. Shahrour, Z. Acar, K. Pellumbi, J. T. Kleinhaus, L. Wickert, U.-P. Apfel, D. Siegmund |
Substrate Diffusion Electrodes allow for the electrochemical hydrogenation of concentrated alkynol substrate feeds |
iScience 28 (2025) 111789 |
|
Research Area: I
|
|
M. Aeschlimann, J. P. Bange, M. Bauer, U. Bovensiepen, H.-J. Elmers, T. Fauster, L. Gierster, U. Hoefer, R. Huber, A. Li, X. Li, S. Mathias, K. Morgenstern, H. Petek, M. Reutzel, K. Rossanagel, G. Schoenhense, M. Scholz, B. Stadtmueller, J. Staehler, S. Tan, B. Wang, Z. Wang, M. Weinelt |
Time-resolved photoelectron spectroscopy at surfaces |
Surf. Sci. Rep. 753 (2025) 122631 |
|
Research Area: I
|
|
M. Zaeh, C. Brandenbusch, S. Groel, G. Winter, G. Sadowski |
Water Activity as an Indicator for Antibody Storage Stability in Lyophilized Formulations |
Mol. Pharmaceutics 22 (2025) 918-926 |
|
Research Area: III
|
|
D. Paschek, J. Busch, A. M. C. Tony, R. Ludwig, A. Strate, N. Stolte, H. Forbert, D. Marx |
When theory meets experiment: What does it take to accurately predict 1H NMR dipolar relaxation rates in neat liquid water from theory? |
J. Chem. Phys. 162 (2025) 54501 |
|
Research Area: I
|
|
R. Haas, O. Lampret, S. Yadav, U.-P. Apfel, T. Happe |
A Conserved Binding Pocket in HydF is Essential for Biological Assembly and Coordination of the Diiron Site of [FeFe]-Hydrogenases |
J. Am. Chem. Soc 146 (2024) 15771-15778 |
|
Research Area: II
|
|
L. Ostermeier, M. Ascani, N. Gajardo-Parra, G. Sadowski, C. Held, R. Winter |
Leveraging liquid-liquid phase separation and volume modulation to regulate the enzymatic activity of formate dehydrogenase |
Biophys. Chem. 304 (2024) 107128 |
|
Research Area: III
|
|
M. Guillen, S. Liu, C. D. Diaz-Oviedo, M. Klussmann, B. List |
Acid-Catalyzed Oxy-aminomethylation of Styrenes |
ACS Catal. 14 (2024) 751-756 |
|
Research Area: II
|
|
B. Pieczyrak, A. Bera, K. Dilchert, V. H. Gessner, G. Antczak, L. Jurczyszyn, K. Morgenstern |
Adsorption and Visualization of Solvated Na/Br Carbenoids on Ag(111) |
J. Phys. Chem. C 128 (2024) 9520-9528 |
|
Research Area: II
|
|
J. Wang, J. H. Marks, A. K. Eckhardt, R. I. Kaiser |
Bottom-Up Formation of Antiaromatic Cyclobutadiene (c-C4H4) in Interstellar Ice Analogs |
J. Am. Chem. Soc. 15 (2024) 1211-1217 |
|
Research Area: II
|
|
D. Das Mahanta, D. Robinson Brown, T. Webber, S. Pezzoti, G. Schwaab, S. Han, M. S. Shell, M. Havenith |
Bridging the Gap in Cryopreservation Mechanism: Unraveling the Interplay between Structure, Dynamics, and Thermodynamics in Cryoprotectant Aqueous Solutions |
J. Phys. Chem. B 128 (2024) 3720-3731 |
|
Research Area: III
|
|
V. N. Wakchaure, W. DeSnoo, C. J. Laconsay, M. Leutzsch, N. Tsuji, D. J. Tantillo, B. List |
Catalytic asymmetric cationic shifts of aliphatic hydrocarbons |
Nature 625 (2024) 287-292 |
|
Research Area: II
|
|
A. Mikula, M. Kozusznik, K. Mars, J. Cieslak, S. Sanden, U.-P. Apfel |
Cobalt-Rich Multimetallic Selenides-Exploring Relationships between Chemical Composition, Temperature Treatment, and Electrocatalytic Performance of Solid Electrodes |
Chem. Mater. 36 (2024) 4571-4582 |
|
Research Area: I
|
|
R. Zerdoumi, A. Savan, M. Amalraj, E. Batsa Tetteh, F. Lourens, O. A. Krysiak, J. R. C. Junqueira, A. Ludwig, W. Schuhmann |
Combinatorial Screening of Electronic and Geometric Effects in Compositionally Complex Solid Solutions Toward a Rational Design of Electrocatalysts |
Adv. Energy Mater. 14 (2024) 2302177 |
|
Research Area: II
|
|
D. C. Robinson Brown, T. R. Webber, T. M. Casey, J. Franck, M. Scott Shell, S. Han |
Computation of Overhauser Dynamic Nuclear Polarization processes reveals fundamental correlation between water dynamics, structure, and solvent restructuring entropy |
Phys. Chem. Chem. Phys 26 (2024) 14637-14650 |
|
Research Area: I
|
|
M. Sokolov, Y. A. Mastrikov, G. Zvejnieks, D. Bocharov, V. Krasnenko, K. S. Exner, E. A. Kotomin |
Computational Study of Oxygen Evolution Reaction on Flat and Stepped Surfaces of Strontium Titanate |
Catal. Today 432 (2024) 114609 |
|
Research Area: II
|
|
T. J. Shaldehi, L. Meng, S. Rowshanzamir, M. J. Parnian, K. Exner, F. Illas |
Computationally Screening Non-Precious Single Atom Catalysts for Oxygen Reduction in Alkaline Media |
Catal. Today 431 (2024) 114560 |
|
Research Area: I
|
|
M. Tack, M. Usama, N. Kazamer, K. S. Exner, M. Brodmann, S. Barcikowski, S. Reichenberger |
Continuous and Scalable Laser Synthesis of Atom Clusters with Tunable Surface Oxidation for Electrocatalytic Water Splitting |
ACS Appl. Energy Mater 7 (2024) 4057-4067 |
|
Research Area: I
|
|
S. A. Polido, C. Stuani, A. Voigt, P. Banik, J. Kamps, V. Bader, P. Grover, L. J. Krause, I. Zerr, J. Matschke, M. Glatzel, K. F. Winklhofer, E. Buratti, J. Tatzelt |
Cross-seeding by prion protein inactivates TDP-43 |
Brain 147 (2024) 240-254 |
|
Research Area: I
|
|
R. P. Antony, L. A. Cechanaviciute, T. Quast, R. Zerdoumi, S. Saddeler, J. R. C. Junqueira, W. Schuhmann |
Deep reconstruction of Mo-based OER pre-catalysts in water electrolysis at high current densities |
ChemCatChem 16 (2024) e202301023 |
|
Research Area: III
|
|
S. Ntim, M. Sulpizi |
Differential Capacitance of Ionic Liquid Confined between Metallic Interfaces |
J. Phys. Chem. B 128 (2024) 1936-1942 |
|
Research Area: III
|
|
K. S. Exner |
Editorial Overview: Fundamental and Theoretical Electrochemistry (2024) Theoretical approaches for energy conversion on various time and length scales |
Curr. Opin. Electrochem. 43 (2024) 101427 |
|
Research Area: I
|
|
L. Wickert, K. Pellumbi, J. T. Kleinhaus, J. Wolf, K. J. Puring, D. Siegmund, U. -P. Apfel |
Effect of Electrolyte Composition and Mass Transport on Electrochemical Hydrogenations of a Terminal Alkynol |
Chem. Ing. Tech 96 (2024) 607-615 |
|
Research Area: I
|
|
J. T. Kleinhaus, S. Umer, K. Pellumbi, L. Wickert, J. Wolf, K. J. Puring, D. Siegmund, U. -P. Apfel |
Electrochemical Hydrogenation of Aliphatic Aldehydes and Acids using Pentlandite Catalysts |
Chem. Ing. Tech 96 (2024) 598-606 |
|
Research Area: II
|
|
M. W. Jaworek, R. Oliva, R. Winter |
Enabling High Activation of Glucose-6-phosphate Dehydrogenase Activity Trough Liquid Condensate Formation and Compression |
Chem. Eur. J. 30 (2024) e202400690 |
|
Research Area: III
|
|
S. Mukherjee, S. Ramos, S. Pezzotti, A. Kalarikkal, T. M. Prass, L. Galazzo, E. Bordignon, M. Havenith, L. V. Schaefer |
Entropic Tug-of-War Determines Solvent Effects in the Liquid-Liquid Phase Separation of a Globular Protein |
J. Phys. Chem. Lett. 15 (2024) 4047-4055 |
|
Research Area: I
|
|
D. L. Reinhard, D. Kutzinski, M. Hatta, E. Engelage, S. M. Huber |
Evaluation of a Bidentate 'Clamp'-Like Halogen-Bond Donor Motif Based on Iodonium (III) Moieties |
Synlett 35 (2024) 209-214 |
|
Research Area: II
|
|
B. Kosel, K. Bigler, B. C. Buchmueller, S. R. Acharyya, R. Linser, D. Summerer |
Evolved Readers of 5-Carboxylcytosine CpG Dyads Reveal a High Versatility of the Methyl-CpG-Binding Domain for Recognition of Noncanonical Epigenetic Marks |
Angew. Chem. Int. Ed. 63 (2024) e202318837 |
|
Research Area: I
|
|
K. M. J. Aertker, M. R. Pilvankar, T. M. Prass, M. Blech, F. Higel, S. Kasturirangan |
Exploring molecular determinants and pharmacokinetic properties of IgG1-scFv bispecific antibodies |
MAbs 16 (2024) 2318817 |
|
Research Area: I
|
|
V. Chanda, D. Blaudszun, L. Hoof, I. Sanjuan, K. Pellumbi, K. J. Puring, C. Andronescu, U.-P. Apfel |
Exploring the (Dis)-Similarities of Half-Cell and Full Cell Zero-Gap Electrolyzers for the CO2 Electroreduction |
ChemElectroChem 11 (2024) e202300715 |
|
Research Area: II
|
|
M. Koga, D. Kang, Z. N. Heim, B. A. Erckson, N. Haldar, N. Baradaran, M. Havenith, D. M. Neumark |
Extreme Ultraviolet Time-Resolved Photoelectron Spectroscopy of Adenine, Adenosine and Adenosine Monophosphate in a Liquid Flat Jet |
Phys. Chem. Chem. Phys. 26 (2024) 13106-13117 |
|
Research Area: III
|
|
J. Habicht, G. Sadowski, C. Brandenbusch |
Fitting Error vs Parameter Performance - How to Choose Reliable PC-SAFT Pure-Component Parameters by Physics-Informed Machine Learning |
J. Chem. Eng. Data 69 (2024) 482-494 |
|
Research Area: I
|
|
K. S. Exner |
Four Generations of Volcano Plots for the Oxygen Evolution Reaction: Beyond Proton-Coupled Electron Transfer Steps? |
Acc. Chem. Res. 57 (2024) 1336-1345 |
|
Research Area: I
|
|
R. Dec, W. Dzwolak, R. Winter |
From a Droplet to a Fibril and from a Fibril to a Droplet: Intertwined Transition Pathways in Highly Dynamic Enzyme-Modulated Peptide-Adenosine Triphosphate Systems |
J. Am. Chem. Soc 146 (2024) 6045-6052 |
|
Research Area: III
|
|
M. H. Wissing, T. L. Meister, M. K. Nocke, A. Goemer, M. Masovic, L. Knegendorf, Y. Brueggemann, V. Bader, A. Siddharta, C.-T. Bock, A. Ploss, S. P. Kenney, K. F. Winklhofer, P. Behrendt, H. Wedemeyer, E. Steinmann, D. Todt |
Genetic determinants of host- and virus-derived insertions for hepatitis E virus replication |
Nat. Commun. 15 (2024) 4855 |
|
Research Area: III
|
|
W. Zao, M. Khalili, Y. Wang, M. Hoffmann, M. van Delden, T. Musch, C. J. Saraceno |
GHz repetition rate, sub-100-fs Ho:CALGO laser at 2.1 ?m with watt-level average power |
Opt. Lett. 49 (2024) 1591-1594 |
|
Research Area: I
|
|
K. Edenharter, M. W. Jaworek, V. Engelbrecht, R. Winter, T. Happe |
H2-production under stress: [FeFe]-hydrogenases reveal strong stability in high pressure environments |
Science 308 (2024) 107217 |
|
Research Area: III
|
|
E. Benchimol, I. Regeni, B. Zhang, M. Kabiri, J. J. Holstein, G. H. Clever |
Heteromeric Completive Self-Sorting in Coordination Cage Systems |
J. Am. Chem. Soc 146 (2024) 6905-6911 |
|
Research Area: II
|
|
A. Omar, M. Hoffmann, G. Galle, F. Sylla, C. J. Saraceno |
Hybrid air-bulk multi-pass cell compressor for high pulse energies with full spatio-temporal characterization |
Opt. Express 32 (2024) 13235-13248 |
|
Research Area: III
|
|
Y. H. Tao, S. Schulke, G. Schwaab, A. R. Harvey, V. P. Wallace, M. Havenith |
Hydration Water Drives the Self-assembly of Guanosine Monophosphate |
Biophys. J. 123 (2024) 931-939 |
|
Research Area: II
|
|
L. Sobota, C. J. Bondue, P. Hosseini, C. Kaiser, M. Spallek, K. Tschulik |
Impact of the Electrochemically Inert Furan Ring on the Oxidation of the Alcohol and Aldehyde Functional Group of 5-Hydroxymethylfurfural (HMF) |
ChemElectroChem 11 (2024) e202300151 |
|
Research Area: II
|
|
M. Sims, M. Wang, J. Wordsworth, A. Alinezhad, R. D. Tilley, W. Schuhmann, J. Ho, T. M. Benedetti, J. J. Gooding |
In Nanoconfined Environments, Larger Ions in the Electrolyte Influence the Local Proton Availability for the Oxygen Reduction Reaction |
J. Phys. Chem. C 128 (2024) 157-165 |
|
Research Area: III
|
|
C. Schunke, P. Schweer, E. Engelage, D. Austin, E. D. Switzer, T. S. Rahman, K. Morgenstern |
Increased Selectivity in Photolytic Activation of Nanoassemblies Compared to Thermal Activation in On-Surface Ullmann Coupling |
ACS Nano 18 (2024) 11665-11674 |
|
Research Area: III
|
|
D. Schick, Q. Chen, L. Hellfajer, A. Strangmann, P. Figiel, J. P. M. Trusler, G. Sadowski, C. Held |
Influence of Solvents and Salts on CO2 Solubility and the Impact on an Esterification Reaction |
J. Chem. Eng. Data 69 (2024) 560-572 |
|
Research Area: II
|
|
T. Yang, S. Sleziona, E. Pollmann, E. Hasselbrink, P. Kratzer, M. Schleberger, R. K. Campen, Y. Tong |
Isolating the optical response of a MoS2 monolayer under extreme screening of a metal substrate |
Phys. Rev. B 109 (2024) L161402 |
|
Research Area: III
|
|
S. Surendralal, M. Todorova, J. Neugebauer |
Laterally Resolved Free Energy Profiles and Vibrational Spectra of Chemisorbed H Atoms on Pt(111) |
J. Chem. Theory Comput. 20 (2024) 2192-2201 |
|
Research Area: I
|
|
F. Krischer, V. H. Gessner |
Ligand Exchange at Carbon: Synthetic Entry to Elusive Species and Versatile Reagents |
J. Am. Chem. Soc. Au 4 (2024) 1709-1722 |
|
Research Area: II
|
|
T. -C. Lin, L. Engelhard, B. Soeldner, R. Linser, D. Summerer |
Light-Activatable MBD-Readers of 5-Methylcytosine Reveal Domain-Dependent Chromatin Association Kinetics In Vivo |
Adv. Sci 11 (2024) 2307930 |
|
Research Area: I
|
|
J. Kamps, V. Bader, K. F. Winklhofer, J. Tatzelt |
Liquid-liquid phase separation of the prion protein is regulated by the octarepeat domain independently of histidines and copper |
J. Biol. Chem. 300 (2024) 107310 |
|
Research Area: III
|
|
G. Bistoni, A. Altun, Z. Wang, F. Neese |
Local Energy Decomposition Analysis of London Dispersion Effects: From Simple Model Dimers to Complex Biomolecular Assemblies |
Acc. Chem. Res. 57 (2024) 1411-1420 |
|
Research Area: I
|
|
M. Dorn, L. Franke, P. Figiel, S. Kareth, E. Weidner, C. Held, M. Petermann |
Measurement and prediction of CO2-solubility in organic electrolytes for high pressure CO2-reduction |
J. Supercrit. Fluids 210 (2024) 106268 |
|
Research Area: III
|
|
J. Kotschy, B. Soeldner, H. Singh, S. K.Vasa, R.Linser |
Microsecond Timescale Conformational Dynamics of a Small-Molecule Ligand within the Active Site of a Protein |
Angew. Chem. Int. Ed. 63 (2024) e202313947 |
|
Research Area: I
|
|
R. Oliva, L. Ostermeier, M. Jaworek, P. Del Vecchio, N. Gajardo-Parra, E. Cea-Klapp, C. Held, L. Petraccone, R. Winter |
Modulation of protein-saccharide interactions by deep-sea osmolytes under high pressure stress |
Int. J. Biol. Macromol. 255 (2024) 128119 |
|
Research Area: III
|
|
J. T. Metternich, J. Ackermann, S. Kruss |
Molekulare Architektur: Nanosensoren mit DNA-Ankern |
Biospektrum 30 (2024) 165-167 |
|
Research Area: I
|
|
M. Campanile, E. D. Kurtul, R. Dec, S. Moebitz, P. Del Vecchio, L. Petraccone, J. Tatzelt, R. Oliva, R. Winter |
Morphological Transformations of SARS-CoV-2 Nucleocapsid Protein Biocondensates Mediated by Antimicrobial Peptides |
Chem. Eur. J. 30 (2024) e202400048 |
|
Research Area: I
|
|
S. Blauth, M. Baldan, S. Osterroth, C. Leithaeuser, U.-P. Apfel, J. Kleinhaus, K. Pellumbi, D. Siegmund, K. Steiner, M. Bortz |
Multi-Criteria Shape Optimization of Flow Fields for Electrochemical Cells |
Chem. Ing. Tech 96 (2024) 616-626 |
|
Research Area: I
|
|
L. Meng, E. Tayyebi, K. S. Exner, F. Vines, F. Illas |
MXenes as Electrocatalysts for the CO2 Reduction Reaction: Recent Advances and Future Challenges |
ChemElectroChem 11 (2024) e202300598 |
|
Research Area: II
|
|
H. Geraili Daronkola, B. Soeldner, H. Singh, R. Linser, A. V. Verde |
Nonlinear impact of electrolyte solutions on protein dynamics |
ChemBioChem 25 (2024) e202400057 |
|
Research Area: I
|
|
K. Wu, E. Benchimol, A. Baksi, G. H. Clever |
Non-statistical assembly of multicomponent [Pd2ABCD] cages |
Nat. Chem. 16 (2024) 584-591 |
|
Research Area: II
|
|
S. Manna, F. Papp, Y. Hisata, J. Loeffler, M. Rybka, V. Gessner, Y. Hoshimoto, L .J. Goossen |
Palladium-Catalyzed gamma-Arylation of Acylketene Synthons with Aryl Chlorides Enabled by Ylide-Functionalized Phosphines (YPhos) |
Adv. Synth. Catal. 366 (2024) 1107-1112 |
|
Research Area: II
|
|
M. Joerges, S. Mondal, M. Kumar, P. Duari, F. Krischer, J. Loeffler, V. H. Gessner |
Phosphinoyl-Substituted Ketenyl Anions: Synthesis and Substituent Effects on the Structural Properties |
Organometallics 43 (2024) 585-593 |
|
Research Area: II
|
|
E. Benchimol, J. Tessarolo, G. H. Clever |
Photoswitchable coordination cages |
Nat. Chem. 16 (2024) 13-21 |
|
Research Area: II
|
|
H. Aucharova, A. Klein, S. M. Gomez, B. Soeldner, S. K. Vasa, R. Linser |
Protein deuteration via algal amino acids to circumvent proton back-exchange for 1H-detected solid-state NMR |
Chem. Commun. 60 (2024) 3083-3086 |
|
Research Area: I
|
|
Q. Sun, A. Eitzinger, R. Esken, P. W. Antoni, R. J. Mayer, A. R. Ofial, M. Hansmann |
Pyridinium-derived mesoionic-N-heterocyclic olefins (py-mNHOs) |
Angew. Chem. Int. Ed. 63 (2024) e202318283 |
|
Research Area: II
|
|
G. Heinrich, M. Kondratiuk, L. J. Goossen, M. P. Wiesenfeldt |
Rapid reaction optimization by robust and economical quantitative benchtop?19F NMR spectroscopy |
Nat. Protoc. 19 (2024) 1529-1556 |
|
Research Area: II
|
|
S. Settele, C. A. Schrange, S. Jung, E. Michel, H. Li, B. S. Flavwel, A. S. K. Hashmi, S. Kruss, J. Zaumseil |
Ratiometric fluorescent sensing of pyrophosphate with sp3-functionalized single-walled carbon nanotubes |
Nat. Commun. 15 (2024) 706 |
|
Research Area: I
|
|
C. Ma, J. M. Mohr, G. Lauer, J.T. Metternich, K. Neutsch,T. Ziebarthc, A. Reinerc, S. Kruss |
Ratiometric imaging of catecholamine neurotransmitters with nanosensors |
Nano Lett. 24 (2024) 2400-2407 |
|
Research Area: I
|
|
A. Jindal, P. Schienbein, D. Marx |
Revealing the Molecular Origin of Anisotropy around Chloride Ions in Bulk Water |
J. Phys. Chem. Lett. 15 (2024) 3037-3042 |
|
Research Area: I
|
|
L. Hensle, K.S. Feichtner, M. Kleinhaus, T. Heinen, N. Boysen, F. Papp, V. H. Gessner |
Reversible Dihydrogen Activation and Catalytic Transfer Hydrogenation with Iminophosphinoyl-Tethered Ruthenium Carbene Complexes |
ChemCatChem 16 (2024) e202301600 |
|
Research Area: II
|
|
N. Suelzner, C. Haettig |
Role of Singles Amplitudes in ADC(2) and CC2 for Low-Lying Electronically Excited States |
J. Chem. Theory Comput. 20 (2024) 2462-2474 |
|
Research Area: I
|
|
J. T. Metternich, B. Hill, J. A.C. Wartmann, C. Ma, R. M. Kruskop, K. Neutsch, S. Herbertz, S. Kruss |
Signal Amplification and Near-Infrared Translation of Enzymatic Reactions by Nanosensors |
Angew. Chem. Int. Ed. 63 (2024) e202316965 |
|
Research Area: I
|
|
J. A. Martinez, I. C. Langguth, D. Olivenza-Leon, K. Morgenstern |
Structure-giving role of Rb+ ions for water-ice nanoislands supported on Cu(111) |
Phys. Chem. Chem. Phys 26 (2024) 13667-13674 |
|
Research Area: III
|
|
S. Schulke, M. Nolten, G. Schwaab, M. Havenith |
Studying local electrostatics by Terahertz spectroscopy using amines as a probe |
ChemPhysChem 25 (2024) e202300389 |
|
Research Area: I
|
|
X. Peng, M. Zhang, H. Qin, J. Han, Y. Xu, W. Li, X.-P. Zhang, W. Zhang, U. -P. Apfel, R. Cao |
Switching Electrocatalytic Hydrogen Evolution Pathways through Electronic Tuning of Copper Porphyrins |
Angew. Chem. Int. Ed. 63 (2024) e202401074 |
|
Research Area: II
|
|
P. J. Kohlpaintner, N. Schupp, N. Ehlenz, L. Marquart, L. J. Goossen, S. R. Waldvogel |
Synthesis of Aromatic-N-Oxides Using Electrochemically Generated Peroxodicarbonate |
Org. Lett. 26 (2024) 1607-1611 |
|
Research Area: II
|
|
S. Maste, B. Sharma, T. Pongratz, B. Grabe, W. Hiller, M. Beck Erlach, W. Kremer, H. R. Kalbitzer, D. Marx, S. M. Kast |
The accuracy limit of chemical shift predictions for species in aqueous solution |
Phys. Chem. Chem. Phys. 26 (2024) 6386-6395 |
|
Research Area: I
|
|
F. Krischer, V. S . V. S. N. Swamy, K. -S. Feichtner, R. J. Ward, V. H. Gessner |
The Cyanoketene Anion [NC3O]- |
Angew. Chem. Int.Ed. 63 (2024) e202403766 |
|
Research Area: II
|
|
M. Day, B. Tetik, M. Parlak, Y. Almeida-Hernandez, M. Raeschle, F. Kaschani, H. Siegert, A. Marko, E. Sanchez-Garcia, M. Kaiser, I. A. Barker, L. H. Pearl, A. W. Oliver , D. Boos |
TopBP1 utilises a bipartite GINS binding mode to support genome replication |
Nat. Commun. 15 (2024) 1797 |
|
Research Area: I
|
|
S. Murke, W. Chen, S. Pezzoti, M. Havenith |
Tuning Acid-Base Chemistry at an Electrified Gold/Water Interface |
J. Am. Chem. Soc 146 (2024) 12423-12430 |
|
Research Area: I
|
|
A. Mikula, M. Kubowicz, M. Smialkowski, S. Sanden, U.-P. Apfel |
Tuning the Electrocatalytic Properties of Trimetallic Pentlandites: Stability and Catalytic Activity as a Function of Material Form and Selenium Concentration |
ACS Mat. Lett. 6 (2024) 1581-1592 |
|
Research Area: II
|
|
P. Banik, K. Ray, J. Kamps, Q.-Y. Chen, H. Luesch, K. F. Winklhofer, J. Tatzelt |
VCP/p97 mediates nuclear targeting of non-ER-imported prion protein to maintain proteostasis |
Life Science Alliance 7 (2024) e202302456 |
|
Research Area: III
|
|
S. A. Varenichenko, V. Markov, J. F. Goebel, L. J. Goossen, O. K. Farat |
Vilsmeier-Haack-Initiated Formylative Rearrangement of Spirodioxo-lan-5-ones into Functionalized 4,5,6,7-Tetrahydrobenzofurans |
J. Org.Chem 89 (2024) 2840-2846 |
|
Research Area: II
|
|
J. Methorst, N. van Hilten, A. Hoti, K. S. Stroh, H. J. Risselada |
When Data Are Lacking: Physics-Based Inverse Design of Biopolymers Interacting with Complex, Fluid Phases |
J. Chem. Theory Comput. 20 (2024) 1763-1776 |
|
Research Area: I
|
|
S. Razzaq, K. S. Exner |
Why efficient bifunctional hydrogen electrocatalysis requires a change in the reaction mechanism |
iScience 27 (2024) 108848 |
|
Research Area: II
|
|
S. J. Goettl, Z. Yang, C. He, A. Somani, A. Portela-Gonzalez, W. Sander, A. M. Mebel, R. I. Kaiser |
Exploring the chemical dynamics of phenanthrene (C14H10) formation?via?the bimolecular gas-phase reaction of the phenylethynyl radical (C6H5CC) with benzene (C6H6) |
Faraday Discuss. 251 (2024) 509-522 |
|
Research Area: II
|
|
M. Dorn, L. Franke, P. Figiel, S. Kareth, E. Weidner, C. Held, M. Petermann |
Measurement and modeling of the electrical conductivity of organic electrolyte solutions and their mixtures with compressed CO2 |
J. Supercrit. Fluids 212 (2024) 106338 |
|
Research Area: II
|
|
S. S. Nalige, P. Galonska, P. Kelich, L. Sistemich, C. Herrmann, L. Vukovic, S. Kruss, M. Havenith |
Fluorescence changes in carbon nanotube sensors correlate with THz absorption of hydration |
Nat. Commun. 15 (2024) 6770 |
|
Research Area: III
|
|
F. Song, V. Kovac, B, Mohammadi, J. L. Littau, F. Schafenberg, A. M. Angles, I. Vanni, M. Shafiq, L. Orge, G. Gallcioti, S. Djakkani, L. Linsenmeier, M. Cernilec, K. Hartman, S. Jung, J. Tatzelt, J. E. Neumann, M. Damme , S. K Tschirner, S. F Lichtenthaler, F. L. Ricklefs, T. Sauvigny , M. Schmitz, I. Zer, B. Puig, E. Tolosa , I. Ferrer , T. Magnus, M. S Rupnik , D. Sepulveda-Falla, J. Matschke, L. M. Smid , M. Bresjanac, O. Andreoletti, S. Krasemann, S. T. Foliaki, R. Nonno, C. Becker-Pauly, C. Monzo , C. Crozet , C. L. Haigh , M. Glatzel , V. C. Serbec, H. C. Altmeppen |
Cleavage site-directed antibodies reveal the prion protein in humans is shed by ADAM10 at Y226 and associates with misfolded protein deposits in neurodegenerative diseases |
Acta Neuropathol. 148 (2024) 2 |
|
Research Area: III
|
|
L. Kelling, J. Esser, D. Knyszek, V. H. Gessner |
Carbon-Based Weakly Coordinating Anions: Molecular Design, Synthesis and Applications |
Angew. Chem. Int. Ed. 63 (2024) e202405936 |
|
Research Area: II
|
|
D. Jovanovic, M. P. Mohanan, S. M. Huber |
Halogen, Chalcogen, Pnictogen, and Tetrel Bonding in Non-Covalent Organocatalysis: An Update |
Angew. Chem. Int. Ed. 63 (2024) e202404823 |
|
Research Area: II
|
|
P. Duari, A. Sarbajna, C. -H. Yu, V. S. V. S. N. Swamy, K.-S. Feichtner, J. Handelmann, V. H. Gessner |
Influence of Ylide Functionalization on the Catalytic Performance of Ferrocenyldiphosphines in Au(I)-Catalyzed Hydroaminations and Hydrohydrazinations |
ChemCatChem 16 (2024) e202400196 |
|
Research Area: II
|
|
E. Benchimol, K. E. Ebbert, A. Walther, J. J. Holstein, G. H. Clever |
Ligand Conformation Controls Assembly of a Helicate/Mesocate, Heteroleptic [Pd2L2L' 2] Cages and a Six-Jagged [Pd6L12] Ring |
Chem. Eur. J. 30 (2024) e202401850 |
|
Research Area: II
|
|
E. Batsa Tetteh, O. A. Krysiak, A. Savan, M. Kim, R. Zerdoumi,T. Dong Chung, A. Ludwig, W. Schuhmann |
Long Range SECCM Enables HighThroughput Electrochemical Screening of High Entropy Alloy Electrocatalysts at Up ToIndustrial Current Densities |
Small Methods 8 (2024) 2301284 |
|
Research Area: I
|
|
B. Koenig, S. Pezzotti, S. Ramos, G. Schwaab, M. Havenith |
Real-time measure of solvation free energy changes upon liquid-liquid phase separation of alpha-Elastin |
Biophys. J. 123 (2024) 1367-1375 |
|
Research Area: I
|
|
A. Dzienia, D. Just, T. Wasiak, K. Z. Milowska, A. Mielanczyk, N. Labedzki, S. Kruss, D. Janas |
Size Matters in Conjugated Polymer Chirality-Selective SWCNT Extraction |
Adv. Sci. 11 (2024) 2402176 |
|
Research Area: III
|
|
S. M. Gomez, I. Visco, F. Merino, P. Bieling, R. Linser |
Transient Structural Properties of the Rho GDP-Dissociation Inhibitor |
Angew. Chem. Int. Ed. 63 (2024) e202403941 |
|
Research Area: I
|
|
D. A. Drost, C. Merten |
Vibrational Circular Dichroism Spectra of Proline in Water at Different pH Values |
Phys. Chem. Chem. Phys. 26 (2024) 17753-17759 |
|
Research Area: I
|
|
K. Lau, S. Zerebecki, L. Pielsticker, W. Hetaba, K. Dhaka, K. S. Exner, S. Reichenberger, S. Barcikowski |
Fluoride Substitution: Quantifying Surface Hydroxyls of Metal Oxides with Fluoride Ions |
Adv. Mater. Interfaces 11 (2024) 2400237 |
|
Research Area: III
|
|
M. Sokolov, K. S. Exner |
Is the O vs. OH scaling relation intercept more relevant than the ?OOH vs. ?OH intercept to capture trends in the oxygen evolution reaction? |
Chem. Catal. 4 (2024) 101039 |
|
Research Area: II
|
|
I. A. Cechanaviciute, B. Kumari, L. M. Alfesi, C. Andronescu, W. Schuhmann |
Gas Diffusion Electrodes for Electrocatalytic Oxidation of Gaseous Ammonia: Stepping Over the Nitrogen Energy Canyon |
Angew. Chem. Int. Ed. 63 (2024) e202404348 |
|
Research Area: II
|
|
J. Han, H. Tan, K. Guo, H. Lv, X. Peng, W. Zhang, H. Lin, U.-P. Apfel, R. Cao |
The Pull Effect of a Hanging ZnII on Improving the Four-Electron Oxygen Reduction Selectivity with Co Porphyrin |
Angew. Chem. Int. Ed. 63 (2024) e202409793 |
|
Research Area: II
|
|
A. Chakraborty, S. Henkel,G. Schwaab, M. Havenith |
Structural Characterization of Pyruvic Acid Dimers Formed inside Helium Nanodroplets by Infrared Spectroscopy and Ab Initio Study |
J. Phys. Chem. A 128 (2024) 5307-5313 |
|
Research Area: III
|
|
J. Loeffler, N. Kaiser, D. Knyszek, F. Krischer, M. Joerges, K.-S. Feichtner, V. H. Gessner |
P,N-Coordinating Ylide-Functionalized Phosphines (NYPhos): A Ligand Platform for the Selective Monoarylation of Small Nucleophiles |
Angew. Chem. Int. Ed. 63 (2024) e202408947 |
|
Research Area: II
|
|
V. S. V. S. N. Swamy, F. Krischer, C. Schwarz, H. Steinert, B. Mallick, V. H. Gessner |
Synthesis and Reactivity of Amino(ylide)stannylenes |
J. Inorg. Gen. Chem 650 (2024) e202400079 |
|
Research Area: II
|
|
G. Karir, E. Mendez-Vega, A. Portela-Gonzalez, M. Saraswat, W. Sander, P. Hemberger |
The elusive phenylethynyl radical and its cation: synthesis, electronic structure, and reactivity |
Phys. Chem. Chem. Phys. 26 (2024) 18256-18265 |
|
Research Area: II
|
|
S. Bimmermann, D. Siegmund, K. Ray, U.-P. Apfel |
Investigation of m- and p-xylene linked bimetallic Ni-cyclam-complexes as potential electrocatalysts for the CO2 reduction |
Mat. Today Catal. 6 (2024) ?100058 |
|
Research Area: II
|
|
R. Saeb, N. Noethling, J. Cornella |
Ni(3,5-CF3stb)2(Et2O): A Super-Naked Nickel Complex |
Organometallics 43 (2024) 1511-1516 |
|
Research Area: II
|
|
B. Xue, F. Papp, M. Yang, J. Shen, A. Doppiu, L. J. Goossen |
Pd-Methylnaphthyl-tBuBrettPhos Complexes as Efficient and Selective Catalysts for the Monoarylation of Ammonia and Hydrazine |
ACS Catal. 14 (2024) 11172-11177 |
|
Research Area: II
|
|
D. Schmidt, A. Gawel, S. Sanden, W. Polet, M. P Checinski, F. Hortmann, K. Pellumbi, K. J. Puring, D. Siegmund, U.-P. Apfel |
Insights into the Electrochemical CO2RR Performance and Binding of Small Molecules on Quaternary Thiospinels Ag2FeSn3S8 and Cu2FeSn3S8 |
Inorg. Chem. 63 (2024) 13495-13505 |
|
Research Area: I
|
|
J. T. Han, N. Tsuji, H. Zhou, M. Leutzsch, B. List |
Organocatalytic asymmetric synthesis of Si-stereogenic silacycles |
Nat. Commun. 15 (2024) 5846 |
|
Research Area: II
|
|
N. Beaufort, L. Indendahl, M. Merdanovic, A. Schmidt, D. Podlesainski, T. Richter, T. Neumann, M. Kuszner, I. R. Vetter, P. Stege, S. G. Burston, A. Filipovic, Y. B. Ruiz-Blanco, K. Bravo-Rodrguez, J. Mieres-Perez, C. Beuck, S. Uebel, M. Zobawa, J. Schillinger, R. Malik, K. Todorov-Voelgyi, J. Rey, A. Roberti, B. Hagemeier, B. Wefers, S. A. Mueller, W. Wurst, E. Sanchez-Garcia, A. Zimmermann, X.-Y. Hu, T. Clausen, R. Huber, S. F. Lichtenthaler, C. Schmuck, M. Giese, M. Kaiser, M. Ehrmann, M. Dichgans |
Rational correction of pathogenic conformational defects in HTRA1 |
Nat. Commun. 15 (2024) 5944 |
|
Research Area: I
|
|
G. H. Clever, K. E. Ebbert, E. Benchimol, A. Platzek, C. Drechsler, J. Openy, S. Hasegawa, J. J. Holstein |
Ring-Size Control and Guest-Induced Circularly Polarized Luminescence in Heteroleptic Pd3A3B3 and Pd4A4B4 Assemblies |
Angew. Chem. Int. Ed. 63 (2024) e202413323 |
|
Research Area: II
|
|
A. Alibakhshi, L. V. Schaefer |
Electron iso-density surfaces provide a thermodynamically consistent representation of atomic and molecular surfaces |
Nat. Commun. 15 (2024) 6086 |
|
Research Area: I
|
|
P. Duari, S. Mondal, M. Joerges, V. H. Gessner |
The Lithium Effect in Ketenyl Anion Chemistry |
Chem. Comm. 60 (2024) 9372-9375 |
|
Research Area: II
|
|
N. Luo, M. Turberg, M. Leutzsch, B. Mitschke, S. Brunen, V. N. Wakchaure, N. Noethling, M. Schelwies, R. Pelzer, B. List |
The catalytic asymmetric polyene cyclization of homofarnesol to ambrox |
Nature 632 (2024) 795-801 |
|
Research Area: II
|
|
S. Ni, D. Spinnato, J. Cornella |
Reductive Cyclopropanation through Bismuth Photocatalysis |
J. Am. Chem. Soc. 146 (2024) 22140-22144 |
|
Research Area: II
|
|
J. F. Goebel, S. Manna, P. Satta, N. V. Tzouras, L. J. Goossen |
Introduction of Fluorinated Groups via Photoredox Catalyzed C-H Functionalization |
Synlett 35 (2024) A-G |
|
Research Area: II
|
|
E. Tayyebi, K. S. Exner |
Refining Free-Energy Calculations for Electrochemical Reactions: Unveiling Corrections beyond Gas-Phase Errors for Solvated Species and Ions |
J. Phys. Chem. C 128 (2024) 13732-13742 |
|
Research Area: I
|
|
G. Antczak, W. Kaminski, K. Morgenstern |
Apparent Height of the Metal Atom in Phthalocyanine: Co vs Cu |
J. Phys. Chem. C 128 (2024) 14056-14064 |
|
Research Area: III
|
|
M. Gubler, J. A. Finkler, M. R. Schaefer, J. Behler, S. Goedecker |
Accelerating Fourth-Generation Machine Learning Potentials Using Quasi-Linear Scaling Particle Mesh Charge Equilibration |
J. Chem. Theory Comput. 20 (2024) 7264-7271 |
|
Research Area: I
|
|
H. Guo, D. Tan, C. Merten, C. C. J. Loh |
Enantioconvergent and Site-Selective Etherification of Carbohydrate Polyols through Chiral Copper Radical Catalysis |
Angew. Chem. Int. Ed. 63 (2024) e202409530 |
|
Research Area: II
|
|
Q. Zhao, Q. Zhang, Y. Xu, A. Han, H. He, H. Zheng, W. Zhang, H. Lei, U.-P. Apfel, R. Cao |
Improving Active Site Local Proton Transfer in Porous Organic Polymers for Boosted Oxygen Electrocatalysis |
Angew. Chem. Int. Ed. 63 (2024) e202414104 |
|
Research Area: I
|
|
T. Zheng, N. Noethling, Z. Wang, B. Mitschke, M. Leutzsch, B. List |
A solid noncovalent organic double-helix framework catalyzes asymmetric [6 + 4] cycloaddition |
Science 385 (2024) 765-770 |
|
Research Area: II
|
|
R. Beckmann, C. Schran, F. Brieuc, D. Marx |
Theoretical Infrared Spectroscopy of Protonated Methane Isotopologues |
Phys. Chem. Chem. Phys. 26 (2024) 22846-22852 |
|
Research Area: I
|
|
X. Luo, P. Hou, J. Shen, Y. Kuang, F. Sun, H. Jiang, L. J. Goossen, L. Huang |
Ligand-enabled ruthenium-catalyzed meta-C-H alkylation of (hetero)aromatic carboxylic acids |
Nat. Commun. 15 (2024) 5552 |
|
Research Area: II
|
|
A. T. Srivatsav, K. Liang, M. W. Jaworek, W. Dong, T. Matsuo, A. Grelard, J. Peters, R. Winter, M. Duan |
Residual Membrane Fluidity in Mycobacterial Cell Envelope Layers under Extreme Conditions Underlines Membrane-Centric Adaptation |
J. Phys. Chem. B 128 (2024) 6838-6852 |
|
Research Area: III
|
|
S. M. Gomez, T. I. Gonazelz, S. K. Vasa, R. Linser |
Allostery at a Protein-Protein Interface Harboring an Intermolecular Motional Network |
Angew. Chem. Int. Ed. 63 (2024) e202411472 |
|
Research Area: I
|
|
O. R. Krettek, P.-V. Pottkaemper, P. Cignoni, K. Tschulik, A. von Keudell |
Creation of tungsten and platinum nanoparticles from nanosecond plasmas in water |
J. Phys. D Appl. Phys. 57 (2024) 485201 |
|
Research Area: I
|
|
J. Bloino, S. Jaehnigen, C. Merten |
After 50 Years of Vibrational Circular Dichroism Spectroscopy: Challenges and Opportunities of Increasingly Accurate and Complex Experiments and Computations |
J. Phys. Chem. Lett. 15 (2024) 8813-8828 |
|
Research Area: I
|
|
R. J. Ward, M. Joerges, H. Remm, E. Kiliani, F. Krischer, Q. L. De, V. H. Gessner |
An Azide-Free Synthesis of Metallodiazomethanes Using Nitrous Oxide |
J. Am. Chem. Soc. 146 (2024) 24602-24608 |
|
Research Area: II
|
|
M. Sokolov, K. Doblhoff-Dier, K. S. Exner |
Best practices of modeling complex materials in electrocatalysis, exemplified by oxygen evolution reaction on pentlandites |
Phys. Chem. Chem. Phys. 26 (2024) 22359-22370 |
|
Research Area: I
|
|
M. Koga, D. H. Kang, Z. N. Heim. P. Meyer, B. A. Erickson, N. Haldar, N. Baradaran, M. Havenith, D. M. Neumark |
Extreme ultraviolet time-resolved photoelectron spectroscopy of adenine, adenosine and adenosine monophosphate in a liquid flat jet |
Phys. Chem. Chem. Phys. 26 (2024) 13106-13117 |
|
Research Area: III
|
|
Y. He, Y. Lyu, D. Tymann, P. W. Antoni, M. M. Hansmann |
Cleavage of Carbodicarbenes with N2O for Accessing Stable Diazoalkenes: Two-fold ligand exchange at a C(0)-atom |
Angew. Chem. Int. Ed. 63 (2024) e202415228 |
|
Research Area: II
|
|
B. He, P. Hosseini D. Escalera-Lopez, J. Schulwitz, O. Ruediger, U. Hagemann, M. Heidelmann, S. Debeer, M. Muhler, S. Cherevko, K. Tschulik, T. Li |
Effects of Dynamic Surface Transformation on the Activity and Stability of Mixed Co-Mn Cubic Spinel Oxides in the Oxygen Evolution Reaction in Alkaline Media |
Adv. Energy Mater. - (2024) 2403096 |
|
Research Area: I
|
|
S. A. Sanden, M. Smialkowski, S. Y. Hu, N. Suvagiya, S. Angel, C. Schulz, U.-P. Apfel |
Ternary Pentlandites as Hydrogen Evolution Catalysts in Alkaline Media |
Adv. Energy Sustainability Res. 5 (2024) 2400128 |
|
Research Area: I
|
|
M. Campanile, R. Oliva, P. Del Vecchio, R. Improta, L. Esposito, C. Platella, R. Winter, L. Petraccone |
Experimental and Computational Evidence of a Stable RNA G-triplex Structure at Physiological Temperature in the SARSCoV-2 Genome |
Angew. Chem. Int. Ed. 63 (2024) e202415448 |
|
Research Area: III
|
|
D. L. Reinhard, A. Schmidt, M. Sons, J. Wolf, E. Engelage, S. M. Huber |
Evaluating the halogen bonding strength of a iodoloisoxazolium(III) salt |
Beilstein J. Org. Chem. 20 (2024) 2401-2407 |
|
Research Area: II
|
|
S. Bag, S. Pezzotti, R. Dec, G. Schwaab, R. Winter, M. Havenith |
Unraveling the Hydration Dynamics of the ACC1-13K24-ATP System: From Liquid-to-Droplet to-Amyloid Fibril |
Biophys. J. 123 (2024) 3863-3870 |
|
Research Area: III
|
|
B. Gisevius, A. Duscha, G. Poschmann, K. Stuehler, J. Motte, A. L. Fisse, S. Augustyniak, A. Rehm, P. Renk, C. Boese, D. Hubert, K. Peters, M. Jagst, A. Goemer, D. Todt, V. Bader, M. Tokic, S. Hirschberg, C. Krogias, N. Trampe, C. Coutourier, C. Winnesberg, E. Steinmann, K. Winklhofer, R. Gold, A. Haghikia |
Propionic acid promotes neurite recovery in damaged multiple sclerosis neurons |
Brain Commun. 6 (2024) fcae182 |
|
Research Area: I
|
|
M. Gerbaulet, An. Hemschemeier, T. Happe |
The O2-stable [FeFe]-hydrogenase CbA5H reveals high resilience against organic solvents |
Catal. Sci. Technol. 14 (2024) 7093-7106 |
|
Research Area: II
|
|
J. Kuziola, N. Noethling, M. Leutzsch, J. Cornella |
Synthesis and characterization of chlorotriarylbismuthonium salts |
Chem. Commun. 60 (2024) 10532-10535 |
|
Research Area: II
|
|
M. Merko, S. Delsing, G. W. Busser, M. Muhler |
Regeneration of bulk and silica-supported gallium oxide catalysts applied in the dehydrogenation of methanol to formaldehyde and hydrogen by reaction-oxygen regeneration cycles and oxygen pulses in the feed |
Chem. Eng. J. 499 (2024) 155776 |
|
Research Area: II
|
|
M. Yanbaeva, J. Soyka, J. M. Holthoff, P. Rietsch, E. Engelage, A. Ruff, U. Resch-Genger, R. Weiss, S. Eigler, S. M. Huber |
Dimethylene-Cyclopropanide Units as Building Blocks for Fluorescence Dyes |
Chem. Eur. J. 30 (2024) e202402476 |
|
Research Area: II
|
|
C. Drechsler, A. Baksi, A. Platzek, M. Acar, J. J. Holstein, C. J. Stein, G. H. Clever |
London Dispersion driven Compaction of Coordination Cages in the Gas-phase - A combined Ion Mobility and Theoretical Study |
Chem. Sci. 15 (2024) 19264-19272 |
|
Research Area: II
|
|
A. Behnke, A. Eitzinger, Y. He, P. W. Antoni, A. R. Ofial, M. M. Hansmann |
2-Methylene-1,2-dihydropyridines (2-pyNHOs): Highly Nucleophilic Enamines |
Eur. J. Org. Chem. 27 (2024) e202400373 |
|
Research Area: II
|
|
V. A. Beland, N. Noethling, M. Leutzsch, J. Cornella |
Activation and Catalytic Degradation of SF6 and PhSF5 at a Bismuth Center |
J. Am. Chem. Soc. 146 (2024) 25409-25415 |
|
Research Area: II
|
|
F. Deissenbeck, S. Surendralal M. Todorova, S. Wippermann, J. Neugebauer |
Revealing the Reaction Pathway of Anodic Hydrogen Evolution at Magnesium Surfaces in Aqueous Electrolytes |
J. Am. Chem. Soc. 146 (2024) 30314-30319 |
|
Research Area: III
|
|
M. J. Sharf, N. Tsuji, M. M. Lindner, M. Leutzsch, M. Lokov, E. Parman, I. Leito, B. List |
Highly Acidic Electron-Rich Bronsted Acids Accelerate Asymmetric Pictet-Spengler Reactions by Virtue of Stabilizing Cation-pi Interactions |
J. Am. Chem. Soc. 41 (2024) 28339-28349 |
|
Research Area: II
|
|
W. Xue, E. Benchimol, A. Walther, N. Ouyang, J. J. Holstein, T. K. Ronson, J. Openy, Y. Zhou, K. Wu, R. Chowdhury, G. H. Clever J. R. Nitschke |
Interplay of Stereochemistry and Charge Governs Guest Binding in Flexible ZnII4L4 Cages |
J. Am. Chem. Soc. Au 146 (2024) 32730-32737 |
|
Research Area: II
|
|
M. Zare, D. Sahsah, M. Salenheen, J. Behler, A. Heyden |
Hybrid Quantum Mechanical, Molecular Mechanical, and Machine Learning Potential for Computing Aqueous-Phase Adsorption Free Energies on Metal Surfaces |
J. Chem. Theory Comput. 20 (2024) 8247-8260 |
|
Research Area: III
|
|
J. Kamps, P. Yuste-Checa, F. Mamashli, M. Schmitz, M. Georgina Herrera, S. M. da Silva Correia, K. Gogte, V. Bader, I. Zerr, F. U. Hartl, A. Bracher, K. F. Winklofer, J. Tatzelt |
Regulated Proteolysis Induces Aberrant Phase Transition of Biomolecular Condensates into Aggregates: A Protective Role for the Chaperone Clusterin |
J. Mol. Biol. 436 (2024) 168839 |
|
Research Area: III
|
|
P. Meyer, S. Jaeger, J. Khatri, S. Henkel, G. Schwaab, M. Havenith |
Mixed H2S and H2O Clusters - New Insights into Dispersion-Dominated Hydrogen Bonding |
J. Phys. Chem. A 128 (2024) 9627-9633 |
|
Research Area: III
|
|
M. Saraswat, A. Portela-Gonzalez, E. Mendez-Vega, W. Sander, P. Hemberger |
N-Carbazolyl pi-Radical and Its Antiaromatic Nitrenium Ion: A Threshold Photoelectron Spectroscopic Study |
J. Phys. Chem. A 128 (2024) 9747-9753 |
|
Research Area: II
|
|
A. M. Stingel, C. C. Konkankit, P. Geirgat, P. B. Petersen |
Multi-Exciton and Phonon Dynamics Impact Intraband Transitions in CdSe/ZnS Colloidal Quantum Dots |
J. Phys. Chem. C 128 (2024) 16032-16039 |
|
Research Area: I
|
|
K. Lucht, P. Schweer, Y. Cao, J. Mierez-Perez, I. Ulrich, E. Sanchez-Garcia, W. Sander, K. Morgenstern |
On-Surface Alcohol Formation from a Carbene Precursor |
J. Phys. Chem. C 128 (2024) 15347-15355 |
|
Research Area: III
|
|
E. Rossi, A. Ferrarini, A. Kundu, T. Elsaesser M. Sulpizi |
Structure and Dynamics of ATP and the ATP-Zn2+ Complex in Solution |
J. Phys. Chem. Lett. 15 (2024) 10039-10045 |
|
Research Area: I
|
|
T. M. Prass, P. Garidel, M. Blech, L. V. Schaefer |
Residue-resolved insights into the stabilization of therapeutic proteins by excipients: A case study of two monoclonal antibodies with arginine and glutamate |
mAbs 16 (2024) 2427771 |
|
Research Area: I
|
|
J. Zhang, T. Quast, B. Eid, Y. -T. Chen, R. Zerdoumi, S. Dieckhoefer, J. R. C. Junqueira, S. Seisel, W. Schuhmann |
In-situ electrochemical reconstruction and modulation of adsorbed hydrogen coverage in cobalt/ruthenium-based catalyst boost electroreduction of nitrate to ammonia |
Nat. Commun. 15 (2024) 8583 |
|
Research Area: I
|
|
S. Jaeger, J. Khatri, P. Meyer, S. Henkel, G. Schwaab, A. Nandi, P. Pnadey, K. R. Barlow, M. A. Perkins, G. S. Tschumper, J. M. Bowman, A. van der Avoird, M. Havenith |
On the nature of hydrogen bonding in the H2S dimer |
Nat. Commun. 15 (2024) 9540 |
|
Research Area: III
|
|
J. Kumar, S. Manna, L. J. Goossen |
Introduction of the Trifluoropropionate Moiety into Aromatic Rings via Rhodium-Catalyzed Coupling of Arylboronic Acids with Diazoesters |
Org. Lett. 26 (2024) 8554-8558 |
|
Research Area: II
|
|
T. Koduru, N. Hantman, E. V. Peters, M. W. Jaworek, J. Wang, S. Zhang, S. A. McCallum, R. E. Gillilan, M. J. Fossat, C. Roumestand, A. Sagar, R. Winter, P. Bernado, J. Cherfils, C. A. Royer |
A molten globule ensemble primes Arf1-GDP for the nucleotide switch |
Proc. Natl. Acad. Sci. U.S.A. 121 (2024) e2413100121 |
|
Research Area: III
|
|
M. Foerster, N. Ukoji, C. J. Sahle, J. Niskanen, R. Sakrowski, G. Surmeier, C. Weis, T. Irifune, S. Imoto, H. Yavas, S. Huotari, D. Marx, C. Sternemann, J. S. Tse |
Generating interstitial water within the persisting tetrahedral H-bond network explains density increase upon compressing liquid water |
Proc. Natl. Acad. Sci. U.S.A. 121 (2024) e2403662121 |
|
Research Area: III
|
|
R. K. Raut, S. Matsutani, F. Shi, S. Kataoka, M. Poje, B. Mitschk, S. Maeda, N. Tsuji, B. List |
Catalytic asymmetric fragmentation of cyclopropanes |
Science 368 (2024) 225-230 |
|
Research Area: II
|
|
M. Guillen, M. Leutzsch, B. List |
Catalytic Asymmetric Cycloaddition of Olefins with In Situ Generated N-Boc-Formaldimine |
J. Am. Chem. Soc. 146 (2024) 32292-32297 |
|
Research Area: II
|
|
L. Sistemich, S. Ebbinghaus |
Heat application in live cell imaging |
FEBS Open Bio 14 (2024) 1940-1954 |
|
Research Area: III
|
|
A. Jindal, P. Schienbein, P. K. Gupta, D. Marx |
Ion Effects on Terahertz Spectra of Microsolvated Clusters |
J. Phys. Chem. Lett. 15 (2024) 12387-12392 |
|
Research Area: III
|
|
H. Ashraf, P. Meyer, S. Henkel, G. Schwaab, M. Havenith |
IR spectra of the CH3 stretching region of methylamine monomer, dimer and trimer in helium nanodroplets |
Vib. Spectrosc. 136 (2024) 103761 |
|
Research Area: III
|
|
M. Jagst, A. Goemer, S. Augustyniak, M. Kloehn, A. Rehm, R. G. Ulrich, V. Bader, K. Winklhofer, Y. Brueggemann, R. Gold, B. Gisevius, D. Todt, E. Steinmann |
Modeling extrahepatic hepatitis E virus infection in induced human primary neurons |
PNAS 121 (2024) e2411434121 |
|
Research Area: III
|
|
S. Razzaq, S. Faridi, S. Kenmoe, M. Usama, D. Singh, L. Meng, F. Vines, F. Illias, K. S. Exner |
MXenes Spontaneously Form Active and Selective Single-Atom Centers under Anodic Polarization Conditions |
J. Am. Chem. Soc. 147 (2024) 161-168 |
|
Research Area: I
|
|
F. Deissenbeck, S. Surendralal, M. Todorova, S. Wippermann, J. Neugebauer |
On the origin of univalent Mg+ ions in solution and their role in anomalous anodic hydrogen evolution |
J. Am. Chem. Soc. 146 (2024) 30314-30319 |
|
Research Area: I
|
|
I. Soldo, P. Schweer, M. Qacu, N. Knuefer, D. Olivenza, D. P. Miller, K. Morgenstern |
Ordered Chlorine Layer Formation from a Supersaturation of Chloroform |
J. Phys. Chem. C 47 (2024) 20053-20065 |
|
Research Area: III
|
|
K. Devi, A. Shehzad, M. P. Wiesenfeldt |
Organophotocatalytic Reduction of Benzenes to Cyclohexenes |
J. Am. Chem. Soc. 146 (2024) 34304-34310 |
|
Research Area:
|
|
N. Montesdeoca, J. M. Mohr, S. Kruss, J. Karges |
Shift of cell-death mechanisms in primary human neutrophils with a ruthenium photosensitizer |
J. Biol. Inorg. Chem. - (2024) - |
|
Research Area: III
|
|
A. Walther, G. Tusha, B. Schmidt, J. J. Holstein, L. V. Schaefer, G. Clever |
Solvent-Directed Social Chiral Self-Sorting in Pd2L4 Coordination Cages |
J. Am. Chem. Soc. 146 (2024) 32748-32756 |
|
Research Area: II
|
|
B. Das, S. R. Barragan, B. Bagchi, D. Marx |
Topological Frustration Triggers Ultrafast Dynamics of Monolayer Water Confined in Graphene Slit Pores |
Nano. Lett. 24 (2024) 15623-15628 |
|
Research Area: III
|
|
B. Hill, J. M. Mohr, I. K. Sandvoss, J. Gretz, P. Galosnka, L. Schnitzler, L. Erpenbeck, S. Kruss |
Ratiometric Near Infrared Fluorescence Imaging of Dopamine with 1D and 2D nanomaterials |
Nanoscale 16 (2024) 18534-18544 |
|
Research Area: I
|
|
A. Soleimani, H. J. Risselada |
SMARTINI3: Systematic Parametrization of Realistic Multi-Scale Membrane Models via Unsupervised Learning and Multi-Objective Evolutionary Algorithms |
Sci. Rep. 14 (2024) 25714 |
|
Research Area: I
|
|
M. Lopez, K. S. Exner, F. Vines, F. Illas |
Computational Pourbaix Diagrams for MXenes: A Key Ingredient toward Proper Theoretical Electrocatalytic Studies |
Adv. Theory Simul. 6 (2023) 2200217 |
|
Research Area: II
|
|
J. F. Goebel, J. Loeffler, Z. Zeng, J. Handelmann, A. Hermann, I. Rodstein, T. Gensch, V. H. Gessner, L. J. Goossen |
Computer-Driven Development of Ylide Functionalized Phosphines for Palladium-Catalyzed Hiyama Couplings / Computergesteuerte Entwicklung von Ylid-funktionalisierten Phosphinen fuer Palladium-katalysierte Hiyama-Kupplungen |
Angew. Chem. Int. Ed. 62 (2023) e202216160 |
|
Research Area: II
|
|
L. Wettstein, P. Immenschuh, T. Weil, C. Conzelmann, Y. Almeida-Hernandez, M. Hoffmann, A. Kempf, I. Nehlmeier, R. Lotke, M. Petersen, S. Stenger, F. Kirchhoff, D. Sauter, S. Poehlmann, E. Sanchez-Garcia, J. Muench |
Native and activated antithrombin inhibits TMPRSS2 activity and SARS-CoV-2 infection |
J. Med. Virol. 95 (2023) e28124 |
|
Research Area: III
|
|
P. Wang, A. Frank, F. Zhao, M. M. Nowaczyk, F. Conzuelo, W. Schuhmann |
A Biomimetic Assembly of Folded Photosystem I Monolayers for an Improved Light Utilization in Biophotovoltaic Devices |
Bioelectrochemistry 149 (2023) 108288 |
|
Research Area: II
|
|
B. Battistella, T. Lohmiller, B. Cula, P. Hildebrandt, U. Kuhlmann, H. Dau, S. Mebs, K. Ray |
A New Thiolate-Bound Dimanganese Cluster as a Structural and Functional Model for Class Ib Ribonucleotide Reductases |
Angew. Chem. Int. Ed. 62 (2023) e202217076 |
|
Research Area: II
|
|
K. Pellumbi, J. Wolf, S. C. Viswanathan, L. Wickert, M. A. Kraeenbring, J. T. Kleinhaus, K. junge Puring, F. Oezcan, D. Segets, U.-P. Apfel, D. Siegmund |
Both sides matter: anode configurations alter the activity of electrolyzers for organic hydrogenations |
RSC Sustain. 1 (2023) 631-639 |
|
Research Area: I
|
|
B. Battistella, L. Iffland-Muehlhaus, M. Schuetze, B. Cula, U. Kuhlmann, H. Dau,P. Hildebrandt, T. Lohmiller, S. Mebs, U.-P. Apfel, K. Ray |
Evidence of Sulfur Non-Innocence in [CoII(dithiacyclam)]2+ -Mediated Catalytic Oxygen Reduction Reactions |
Angew. Chem. Int. Ed. 62 (2023) e202214074 |
|
Research Area: I
|
|
Y.-T. Tseng, V. Pelmenschikov, L. Iffland-Muehlhaus, D. Calabrese, Y.-C. Chang, K. Laun, C.-W. Pao, I. Sergueev, Y. Yoda, W.-F. Liaw, C.-H. Chen, I.-J. Hsu, U.-P. Apfel, G. Caserta, L. Lauterbach, T.-T. Lu |
Substrate-Gated Transformation of a Pre-Catalyst into an Iron-Hydride Intermediate [(NO)2(CO)Fe(micro-H)Fe(CO)(NO)2]- for Catalytic Dehydrogenation of Dimethylamine Borane |
Inorg. Chem. 62 (2023) 769-781 |
|
Research Area: II
|
|
A. Mikula, J. Dabrowa, M. Kubowicz, J. Cieslak, W. Lach, M. Kozusznik, M. Smialkowskic, U.-P. Apfel |
Synthesis, properties and catalytic performance of the novel, pseudo-spinel, multicomponent transition-metal selenides |
J. Mater. Chem. A 11 (2023) 5337-5349 |
|
Research Area: II
|
|
H. M. Hueppe, L. Iffland-Muehlhaus, J. Heck, M. Eilers, H. Gildenast, S. Schoenfeld, A. Duerrmann, A. Hoffmann, B. Weber, U.-P. Apfel, S. Herres-Pawlis |
Triflate vs Acetonitrile: Understanding the Iron (II)-Based Coordination Chemistry of Tri (quinolin-8-yl) amine |
Inorg. Chem. 62 (2023) 4435-4455 |
|
Research Area: II
|
|
N. Wang, X.-P. Zhang, J. Han, H. Lei, Q. Zhang, H. Zhang, W. Zhang, U.-P. Apfel, R. Cao |
Promoting hydrogen evolution reaction with a sulfonic proton relay |
Chinese J. Catal. 45 (2023) 88-94 |
|
Research Area: II
|
|
R. Haas, V. Engelbrecht, O. Lampret, S. Yadav, U.-P. Apfel, S. Leimkuehler,T. Happe |
The [4Fe-4S]-Cluster of HydF is not Required for the Binding and Transfer of the diiron site of [FeFe]-Hydrogenases |
ChemBioChem 24 (2023) e202300222 |
|
Research Area: II
|
|
Y. Beyazit, F. Kuehne, D. Diesing, P. Zhou, J. Jayabalan, B. Sothmann, U. Bovensiepen |
Ultrafast electron dynamics in Au/Fe/MgO(001) analyzed by Au- and Fe-selective pumping in time-resolved two-photon photoemission spectroscopy: Separation of excitations in adjacent metallic layers |
Phys. Rev. B 107 (2023) 085412 |
|
Research Area: I
|
|
T. Yang, E. Pollmann, S. Sleziona, E. Hasselbrink, P. Kratzer, M. Schleberger, R. K. Campen, Y. Tong |
Interaction between a gold substrate and monolayer MoS 2: An azimuthal-dependent sum frequency generation study |
Phys. Rev. B 107 (2023) 155433 |
|
Research Area: I
|
|
K. Lau, F. Niemann, K. Abdiaziz, M. Heidelmann, Y. Yang, Y. Tong, M. Fechtelkord, T. C. Schmidt, A. Schnegg, R. K. Campen, B. Peng, M. Muhler, S. Reichenberger, S. Barcikowski |
Differentiating between Acidic and Basic Surface Hydroxyls on Metal Oxides by Fluoride Substitution: A Case Study on Blue TiO2 from Laser Defect Engineering |
Angew. Chem. Int. Ed. 62 (2023) e202213968 |
|
Research Area: III
|
|
J. Tessarolo, E. Benchimol, A. Jouaiti, M. W. Hosseini, G. H. Clever |
Modular Enhancement of Circularly Polarized Luminescence in Pd2A2B2 heteroleptic cages |
Chem. Commun. 59 (2023) 3467-3470 |
|
Research Area: II
|
|
S. Horiuchi, T. Yamaguchi, J. Tessarolo, H. Tanaka, E. Sakuda, Y. Arikawa, E. Meggers, G. H. Clever, K. Umakoshi |
Symmetry-breaking host-guest assembly in a hydrogen-bonded supramolecular system |
Nat. Commun. 14 (2023) 155 |
|
Research Area: II
|
|
J. Wang, J. H. Marks, A. M. Turner, A. M. Mebel, A. K. Eckhardt, R. I. Kaiser |
Gas-phase detection of oxirene |
Sci. Adv. 9 (2023) eadg1134 |
|
Research Area: II
|
|
V. Paczelt, R. C. Wende, P. R. Schreiner, A. K. Eckhardt |
Glycine Imine - The Elusive alpha-Imino Acid Intermediate in the Reductive Amination of Glyoxylic Acid |
Angew. Chem. Int. Ed. 62 (2023) e202218548 |
|
Research Area: II
|
|
J. H. Marks, J. Wang, N. F. Kleimeier, A. M. Turner, A. K. Eckhardt, R. I. Kaiser |
Prebiotic Synthesis and Isomerization in Interstellar Analog Ice: Glycinal, Acetamide, and Their Enol Tautomers |
Angew. Chem. Int. Ed. 62 (2023) e202218645 |
|
Research Area: III
|
|
A. Klein, S. K. Vasa, R. Linser |
5D solid-state NMR spectroscopy for facilitated resonance assignment |
J. Biomol. NMR 77 (2023) 229-245 |
|
Research Area: I
|
|
K. S. Exner |
Importance of the volcano slope to comprehend activity and selectivity trends in electrocatalysis |
Curr. Opin. Electrochem. 39 (2023) 101284 |
|
Research Area: I
|
|
S. Razzaq, K. S. Exner |
Materials Screening by the Descriptor Gmax(ny): The Free-Energy Span Model in Electrocatalysis |
ACS Catal. 13 (2023) 1740-1758 |
|
Research Area: I
|
|
K. S. Exner |
On the concept of metal-hydrogen peroxide batteries: Improvement over metal-air batteries? |
Energy Adv. 2 (2023) 522-529 |
|
Research Area: I
|
|
K. S. Exner |
On the mechanistic complexity of oxygen evolution: potential-dependent switching of the mechanism at the volcano apex |
Mater. Horiz. 10 (2023) 2086-2095 |
|
Research Area: I
|
|
M. Spellauge, M. Tack, R. Streubel, M. Miertz, K. Exner, S. Reichenberger, S. Barcikowski, H. P.Huber, A. R. Ziefuss |
Photomechanical Laser Fragmentation of IrO2 Microparticles for the Synthesis of Active and Redox-Sensitive Colloidal Nanoclusters |
Small 19 (2023) 22206485 |
|
Research Area: II
|
|
K. S. Exner |
Rapid Screening of Mechanistic Pathways for Oxygen-Reduction Catalysts |
ChemCatChem 15 (2023) e202300059 |
|
Research Area: II
|
|
K. S. Exner |
Steering Selectivity in the Four-Electron and Two-Electron Oxygen Reduction Reactions: On the Importance of the Volcano Slope |
ACS Phys. Chem. Au 3 (2023) 190-198 |
|
Research Area: I
|
|
M. Lopez, K. S. Exner, F. Vines, F. Illas |
Theoretical study of the mechanism of the hydrogen evolution reaction on the V2C MXene: Thermodynamic and kinetic aspects |
J. Catal. 421 (2023) 252-263 |
|
Research Area: I
|
|
K. S. Exner |
Standard-state entropies and their impact on the potential-dependent apparent activation energy in electrocatalysis |
J. Energy Chem. 83 (2023) 247-254 |
|
Research Area: I
|
|
M. Joerges, R. M. Gauld, H. Steinert, L. Kelling, V. S. V. S. N. Swamy, A. Kroll, B. Mallick, V. H. Gessner |
Thiophosphinoyl-Tethered Ylide-Substituted Heavier Carbenes: Synthesis, Structures and Stabilities |
Chem. Eur. J. 29 (2023) e202203863 |
|
Research Area: II
|
|
I. Rodstein, A. Doppiu, V. H. Gessner |
Ylide-Functionalized Phosphine (YPhos) Platinum Complexes: Synthesis and Application in Hydrosilylations under Mild Conditions |
Organometallics 42 (2023) 1021-1029 |
|
Research Area: II
|
|
G. Bertoli, A. M. Martinez, J. F. Goebel, D. Belmonte, N. Sivendran, L. J. Goossen |
C-H Fluoromethoxylation of Arenes by Photoredox Catalysis / C-H-Fluormethoxylierung von Aromaten durch Photoredox-Katalyse |
Angew. Chem. Int. Ed. 62 (2023) e202215920 |
|
Research Area: II
|
|
P. J. Kohlpaintner, L. Marquart, L. J. Goossen, S. R. Waldvogel |
The Oxidation of Organo-Boron Compounds Using Electrochemically Generated Peroxodicarbonate |
Chem. Eur. J. 26 (2023) e202300220 |
|
Research Area: II
|
|
J. F. Goebel, J. Stemmer, F. Belitz, L. J. Goossen |
Manganese(I) Catalyzed ortho C-H Allylation of Benzoic Acids |
Angew. Chem. Int. Ed. 62 (2023) e202301839 |
|
Research Area: II
|
|
F. Papp, D. Sowa Prendes, S. Manna, A. K. Seitz, S. Kostiukovska, J. Loeffler, V. H. Gessner, L. Goossen |
Palladium-Catalyzed Arylation of Hydantoins with Aryl Chlorides Enabled by Ylide-Functionalized Phosphines (YPhos) |
ACS Catal. 13 (2023) 6846-6850 |
|
Research Area: II
|
|
T. van Lingen, V. Bragoni, M. Dyga, B. Exner, L. Goossen, D. Schick, C. Held, G. Sadowski |
Carboxylation of Acetylene without Salt Waste: Green Synthesis of C4 Chemicals Enabled by a CO2-Pressure Induced Acidity Switch |
Angew. Chem. Int. Ed. 62 (2023) e202303882 |
|
Research Area: II
|
|
S. Tsuru, B. Sharma, D. Marx, C. Haettig |
Structural Sampling and Solvation Models for the Simulation of Electronic Spectra: Pyrazine as a Case Study |
J. Chem. Theory Comput. 19 (2023) 2291-2303 |
|
Research Area: I
|
|
J. Duan, A. Hemschemeier, D. J. Burr, S. T. Stripp, E. Hofmann, T. Happe |
Cyanide Binding to [FeFe]-Hydrogenase Stabilizes the Alternative Configuration of the Proton Transfer Pathway |
Angew. Chem. Int. Ed. 62 (2023) e202216903 |
|
Research Area: II
|
|
A. Rutz, C. K. Das, A. Fasano, J. Jaenecke, S. Yadav, U.-P. Apfel, V. Engelbrecht, V. Fourmond, C. Leger, L. V. Schaefer, T. Happe |
Increasing the O2 Resistance of the [FeFe]-Hydrogenase CbA5H through Enhanced Protein Flexibility |
ACS Catal. 13 (2023) 856-865 |
|
Research Area: I
|
|
N. Suelzner, C. Haettig |
Computational investigation of explicit solvent effects and specific interactions of hydroxypyrene photoacids in acetone, DMSO, and water |
Phys. Chem. Chem. Phys. 25 (2023) 11130-11144 |
|
Research Area: I
|
|
H. Hao, E. M. Adams, S. Funke, G. Schwaab, M. Havenith, T. Head-Gordon |
Highly Altered State of Proton Transport in Acid Pools in Charged Reverse Micelles |
J. Am. Chem. Soc. 145 (2023) 1826-1834 |
|
Research Area: I
|
|
S. Pezzotti, B. Koenig, S. Ramos, G. Schwaab, M. Havenith |
Liquid-Liquid Phase Separation? Ask the Water! |
J. Phys. Chem. Lett. 14 (2023) 1556-1563 |
|
Research Area: I
|
|
A. G. Markelz, M. Havenith, C. Hough |
THz Biological Effects and Sensing |
J. Phys. D 56 (2023) 223001 |
|
Research Area: I
|
|
C. Hoberg, J. J. Talbot, J. Shee, T. Ockelmann, D. Das Mahanta, F. Novelli, M. Head-Gordon, M. Havenith |
Caught in the act: real-time observation of the solvent response that promotes excited-state proton transfer in pyranine |
Chem. Sci. 14 (2023) 4048-4058 |
|
Research Area: I
|
|
F. Novelli, K. Chen, A. Buchmann, T. Ockelmann, C. Hoberg, T. Head-Gordon, M. Havenith |
The birth and evolution of solvated electrons in the water |
Proc. Natl. Acad. Sci. U.S.A. 120 (2023) e2216480120 |
|
Research Area: I
|
|
S. Murke, K.Wonner, S. R. Alfarano, C. Rurainsky, P. Cignoni, K. Tschulik, M. Havenith |
SERS Reveals the Presence of Au-O-O-H and Enhanced Catalytic Activity of Electrochemically Dealloyed AgAu Nanoparticles |
J. Phys. Chem. C 127 (2023) 1071-1076 |
|
Research Area: I
|
|
R. Robidas, D. L. Reinhard, S. M. Huber, C. Y. Legault |
A quantum-chemical analysis on the Lewis acidity of diaryl-halonium ions |
ChemPhysChem 24 (2023) e202200634 |
|
Research Area: II
|
|
T. Steinke, E. Engelage, S. M. Huber |
Chalcogen bonding in the solid-state structures of 1,3-bis(benzimidazoliumyl)benzene-based chalcogen-bonding donors |
Acta Crystallogr. C Struct. Chem. 79 (2023) 26-35 |
|
Research Area: II
|
|
J. S. Holsapple, L. Schnitzler, L. Rusch, T. H. Baldeweg, E. Neubert, S. Kruss, L. Erpenbeck |
Expansion microscopy of neutrophil nuclear structure and extracellular traps |
Biophys. J. 3 (2023) 100091 |
|
Research Area: I
|
|
P. Galonska, J. M. Mohr, C. A. Schrage, L. Schnitzler, S. Kruss |
Guanine quantum defects in carbon nanotubes for biosensing |
J. Chem. Phys. Lett. 14 (2023) 3483-3490 |
|
Research Area: I
|
|
J. Ackermann, J. Stegemann, T. Smola, E. Reger, S. Jung, A. Schmitz, S. Herbertz, L. Erpenbeck, K. Seidl, S. Kruss |
High sensitivity near-infrared imaging of fluorescent nanosensors |
Small 19 (2023) 2206856 |
|
Research Area: I
|
|
L. Sistemich, P. Galonska, J. Stegemann, J. Ackermann, S. Kruss |
Near-Infrared Lifetime Imaging of Biomolecules with Carbon Nanotubes |
Angew. Chem. Int. Ed. 62 (2023) e202300682 |
|
Research Area: II
|
|
S. Das, C. Zhu, D. Demirbas, E. Bill, C. K. De, B. List |
Asymmetric counteranion-directed photoredox catalysis |
Science 376 (2023) 494-499 |
|
Research Area: II
|
|
J. A. A. Grimm, H. Zhou, R. Properzi, M. Leutzsch, G. Bistoni, J. Nienhaus, B. List |
Catalytic asymmetric synthesis of cannabinoids and menthol from neral |
Nature 615 (2023) 634-639 |
|
Research Area: II
|
|
H. Zhou, R. Properzi, M. Leutzsch, P.Belanzoni, G. Bistoni, N. Tsuji, J. T. Han, C. Zhu, B. List |
Organocatalytic DYKAT of Si-Stereogenic Silanes |
J. Am. Chem. Soc. 145 (2023) 4994-5000 |
|
Research Area: II
|
|
N. Tsuji , P. Sidorov, C. Zhu, Y. Nagata, T. Gimadie, A. Varnek, B. List |
Predicting Highly Enantioselective Catalysts Using Tunable Fragment Descriptors |
Angew. Chem. Int. Ed. 62 (2023) e202218659 |
|
Research Area: II
|
|
R. Beckmann, R. Topolnicki, D. Marx |
Deciphering the Impact of Helium Tagging on Flexible Molecules: Probing Microsolvation Effects of Protonated Acetylene by Quantum Configurational Entropy |
J. Phys. Chem. A 127 (2023) 2460-2471 |
|
Research Area: III
|
|
B. Das, S. R. Barragan, D. Marx |
Deciphering the Properties of Nanoconfined Aqueous Solutions by Vibrational Sum Frequency Generation Spectroscopy |
J. Phys. Chem. Lett. 14 (2023) 1208-1213 |
|
Research Area: III
|
|
J. A. Davies, C. Schran, F. Brieuc, D. Marx, A. M. Ellis |
Onset of Rotational Decoupling for a Molecular Ion Solvated in Helium: From Tags to Rings and Shells |
Phys. Rev. Lett. 130 (2023) 83001 |
|
Research Area: III
|
|
V. U. B. Rao, C. Wang, D. P. Demarque, C. Grassin, F. Otte, C. Merten, C. Strohmann, C. C. J. Loh |
A synergistic Rh(I)/organoboron-catalysed site-selective carbohydrate functionalization that involves multiple stereocontrol |
Nat. Chem. 15 (2023) 424-235 |
|
Research Area: II
|
|
J. Liu, S. Mallick, Y. Xie, C. Grassin, B. Lucas, B. Schoelermann, A. Pahl, R. Scheel, C. Strohmann, C. Protzel, T. Berg, C. Merten, S. Ziegler, H. Waldmann |
Morphological profiling identifies the motor protein Eg5 as cellular target of spirooxindoles |
Angew. Chem. Int. Ed 62 (2023) e202301955 |
|
Research Area: II
|
|
N. Osterloh, T. Pan, K. Morgenstern |
Locally varying formation of nanoclusters across a low-intensity ultra-short laser spot |
Nanoscale Horiz. 8 (2023) 55-62 |
|
Research Area: I
|
|
C. Penschke, J. Thomas, C. Bertram, A. Michaelides, K. Morgenstern, P. Saalfrank, U. Bovensiepen |
Hydration at highly crowded interfaces |
Phys. Rev. Lett. 130 (2023) 106202 |
|
Research Area: III
|
|
I. A. Cechanaviciute, R. P. Antony, O. A. Krysiak, T. Quast, S. Dieckhoefer, S. Saddeler, P. Telaar, Y.-T. Chen, M. Muhler, W. Schuhmann |
Scalable synthesis of multi-metal electrocatalyst powders and electrodes and their application for oxygen evolution and water splitting |
Angew. Chem. Int. Ed. 62 (2023) e202218493 |
|
Research Area: II
|
|
W. Chen, S. E. Sanders, B. Oezdamar, D. Louaas, F. S. Brigiano, S. Pezzotti, P. B. Petersen, M.-P. Gaigeot |
On the Trail of Molecular Hydrophilicity and Hydrophobicity at Aqueous Interfaces |
J. Phys. Chem. Lett. 14 (2023) 1301-1309 |
|
Research Area: I
|
|
S. M. Piontek, D. Naujoks, T. Tabassum, M.J. Dello Stritto, M. Jaugstetter, P. Hosseini, M. Corva, A. Ludwig, K. Tschulik, M. L. Klein, P. B. Petersen |
Probing the Gold/Water Interface with Surface-Specific Spectroscopy |
ACS Phys. Chem. Au 3 (2023) 119-129 |
|
Research Area: III
|
|
Y. Hioki, M. Costantini, J. Griffin, K. C. Harper, M. Prado Merini, B. Nissl, Y. Kawamata, P. S. Baran |
Overcoming the limitations of Kolbe coupling with waveform-controlled electrosynthesis |
Science 380 (2023) 81-87 |
|
Research Area: II
|
|
N. van Hilten, J. Methorst, N. Verwei, H. J. Risselada |
Physics-based generative model of curvature sensing peptides, distinguishing sensors from binders |
Sci. Adv. 9 (2023) 8839 |
|
Research Area: I
|
|
D. Schick, M. Arrad, P. Figiel, G. Sadowski, C. Held |
Modeling the temperature-dependent solubility of salts in organic solvents |
Fluid Phase Equilib. 572 (2023) 113828 |
|
Research Area: II
|
|
J. Habicht, C. Brandenbusch, G. Sadowski |
Predicting PC-SAFT pure-component parameters by machine learning using a molecular fingerprint as key input |
Fluid Phase Equilib. 565 (2023) 113657 |
|
Research Area: I
|
|
M. Zaeh, C. Brandenbusch, G. Winter, G. Sadowski |
Predicting the amorphous-phase composition during lyophilization |
Int. J. Pharm. 636 (2023) 122836 |
|
Research Area: III
|
|
M. Ascani, G. Sadowski, C. Held |
Simultaneous Predictions of Chemical and Phase Equilibria in Systems with an Esterification Reaction Using PC-SAFT |
Molecules 28 (2023) 1768 |
|
Research Area: II
|
|
D. Schick. L. Bierhaus, A. Strangmann, P. Figiel, G. Sadowski, C. Held |
Predicting CO2 solubility in aqueous and organic electrolyte solutions with ePC-SAFT advanced |
Fluid Phase Equilib. 567 (2023) 113714 |
|
Research Area: II
|
|
L. R. Olari, R. Bauer, M. G. Miro, V. Vogel, L. Cortez Rayas, R. Gross, A. Gilg, R. Klevesath, A. A. Rodriguez Alfonso, K. Kaygisiz, U. Rupp, P. Pant, J. Mieres-Perez, L. Steppe, R. Schaeffer, L. Rauch-Wirth, C. Conzelmann, J. A. Mueller, F. Zech, F. Gerbl, J. Bleher, N. Preising, L. Staendker, S. Wiese, D. R. Thal, C. Haupt, H. R. A. Jonker, M. Wagner, E. Sanchez-Garcia, T. Weil, S. Stenger, M. Faendrich, J. von Einem, C. Read, P. Walther, F. Kirchhoff, B. Spellerberg, J. Muench |
The C-terminal 32-mer fragment of hemoglobin alpha is an amyloidogenic peptide with antimicrobial properties |
Cell. Mol. Life Sci. 80 (2023) 151 |
|
Research Area: II
|
|
H. Shahpasand-Kroner, I. Siddique, R. Malik, G. Linares, M. I. Ivanova, J. Ichida, T. Weil, J. Muench, E. Sanchez-Garcia, F.-G. Klaerner, T. Schrader, G. Bitan |
Molecular tweezers - supramolecular hosts with broad-spectrum biological applications |
Pharmacol. Rev. 75 (2023) 263-308 |
|
Research Area: II
|
|
K. Lucht, I. Ulrich, W. Sander, K. Morgenstern |
Selectivity of Laser-Induced versus IET-Induced Carbene Formation from Methoxydiazofluorene on Ag (111) |
J. Phys. Chem. C 127 (2023) 562-567 |
|
Research Area: III
|
|
Y. Cao, J. Mieres-Perez, K. Lucht, I. Ulrich, P. Schweer, E. Sanchez-Garcia, K. Morgenstern, W. Sander |
C-C Coupling of Carbene Molecules on a Metal Surface in the Presence of Water |
J. Am. Chem. Soc 145 (2023) 11544-11552 |
|
Research Area: II
|
|
C. Millon, S. Houver, C. Saraceno |
400 kHz repetition rate THz-TDS with 24 mW of average power driven by a compact industrial Yb-laser |
Opt. Express 31 (2023) 7922-7932 |
|
Research Area: I
|
|
S. Mansourzadeh, T.Vogel, A. Omar, M. Shalaby, M. Cinchetti, C. Saraceno |
Broadband, high power THz source at 540 kHz using organic crystal BNA |
APL Photonics 8 (2023) 113001 |
|
Research Area: I
|
|
A. Omar, T. Vogel, M. Hoffmann, C. Saraceno |
Spectral broadening of 2 mJ femtosecond pulses in a compact air-filled convex-concave multi-pass cell |
Opt. Lett. 48 (2023) 1458-1461 |
|
Research Area: I
|
|
W. Yao, Y. Wang, S. Ahmed, M. Saraceno, M. Delden,T. Musch, C. Saraceno |
Low-noise, 2-W average power, 112-fs Kerr-lens mode-locked Ho: CALGO laser at 2.1 micro meter |
Opt. Lett. 48 (2023) 2801-2804 |
|
Research Area: I
|
|
H.-G. Lee, A. Dhamija, C. K. Das, K. M. Park, Y.-T. Chang, L. V. Schaefer, K. Kim |
Synthetic Monosaccharide Channels: Size-Selective Transmembrane Transport of Glucose and Fructose Mediated by Porphyrin Boxes |
Angew. Chem. Int. Ed. 62 (2023) e202214326 |
|
Research Area: I
|
|
B. Soeldner, K. Grohe, P. Neidig, J. Auch, S. Blach, A. Klein, S. K. Vasa, L. V. Schaefer, R. Linser |
Integrated assessment of structure and dynamics of solid proteins |
J. Phys. Chem. Lett. 14 (2023) 1725-1731 |
|
Research Area: I
|
|
M. Kim, E. B. Tetteh, A. Savan, B. Xiao, A. Ludwig, W. Schuhmann, T. Dong Chung |
Reorganization energy in a polybromide ionic liquid measured by scanning electrochemical cell microscopy |
J. Chem. Phys. 158 (2023) 134707 |
|
Research Area: I
|
|
J. Zhang, W. He, T. Quast, J. R. C. Junqueira, S. Saddeler, S. Schulz, W. Schuhmann |
Single-entity Electrochemistry Unveils Dynamic Transformation during Tandem Catalysis of Cu2O and Co3O4for Converting NO3- to NH3 |
Angew. Chem. Int. Ed. 62 (2023) e202214830 |
|
Research Area: I
|
|
A. J. DeStefano, M. Nguyen, G. H. Fredrickson, S. Han, R. A. Segalman |
Design of Soft Material Surfaces with Rationally Tuned Water Diffusivity |
ACS Cent. Sci. 9 (2023) 1019-1024 |
|
Research Area: I
|
|
M. Rahbar, C. J. Stein |
A statistical perspective on microsolvation |
J. Phys. Chem. A 127 (2023) 2176-2193 |
|
Research Area: III
|
|
E. Rossi, A. Ferrarini, M. Sulpizi |
Modeling of minimal systems based on ATP-Zn coordination for chemically fueled self-assembly |
Phys. Chem. Chem. Phys. 25 (2023) 6102-6111 |
|
Research Area: II
|
|
Z. Liu, H. M. A. Amin, Y. Peng, M. Corva, R. Pentcheva, K. Tschulik |
Facet-Dependent Intrinsic Activity of Single Co3O4 Nanoparticles for Oxygen Evolution Reaction |
Adv. Funct. Mater. 33 (2023) 2210945 |
|
Research Area: I
|
|
M. A. Sani, K. Tschulik |
Unveiling colloidal nanoparticle properties and interactions at a single entity level |
Curr. Opi. Electrochem 37 (2023) 101195 |
|
Research Area: I
|
|
A. M.Tsirigoni, M. Goktas, Z. Atris, A. Valleriani, A. Vila Verde, K. G. Blank |
Chain Sliding versus beta-Sheet Formation upon Shearing Single alpha-Helical Coiled Coils |
Macromol. Biosci. 23 (2023) 2200563 |
|
Research Area: III
|
|
S. Goel, R. Oliva, S. Jeganathan, V. Bader, L. J. Krause, S. Kriegler, I. D. Stender, C. W. Christine, K. Nakamura, J. E. Hoffmann, R. Winter, J. Tatzelt, K. F. Winklhofer |
Linear ubiquitination induces NEMO phase separation to activate NF-kappaB signaling |
Life Science Alliance 6 (2023) e02201607 |
|
Research Area: I
|
|
S. Kriegler, M. W. Jaworek, R. Oliva, R. Winter |
High pressure treatment promotes the deteriorating effect of cationic antimicrobial peptides on bacterial membranes |
Phys. Chem. Chem. Phys. 25 (2023) 11185-11191 |
|
Research Area: III
|
|
J.-M. Knop, S. Mukherjee, M. W. Jaworek, S. Kriegler, M. Manisegaran, Z. Fetahaj, L. Ostermeier, R. Oliva, S. Gault, C. S. Cockell, R. Winter |
Life in Multi-Extreme Environments: Brines, Osmotic and Hydrostatic Pressure - A Physicochemical View |
Chem Rev. 123 (2023) 73-104 |
|
Research Area: III
|
|
L. Misuraca, R. Winter, B. Deme, P. M. Oger, J. Peters |
Molecular Rearrangements in Protomembrane Models Probed by Laurdan Fluorescence |
Membranes 13 (2023) 386 |
|
Research Area: III
|
|
A. Tortorella, L. Leone, A. Lombardi , E. Pizzo, A. Bosso, R. Winter, L. Petraccone, P. D. Vecchio, R. Oliva |
The impact of N-glycosylation on the properties of the antimicrobial peptide LL-III |
Sci. Rep. 13 (2023) 3733 |
|
Research Area: III
|
|
M. Campanile, R. Oliva, P. Del Vecchio, R. Winter, L. Petraccone |
The anticancer peptide LL-III binds with nanomolar affinity to human telomeric and cMyc G-quadruplexes |
Chem. Commun. 59 (2023) 6179-6182 |
|
Research Area: III
|
|
N. M. Kreienborg, F. Otte, C. Strohmann, C. Merten |
Simultaneous observation of halogen-lone pair and halogen-pi interactions of ferrocene derivatives under cryogenic conditions |
Phys. Chem. Chem. Phys 25 (2023) 15110-15114 |
|
Research Area: II
|
|
E. Cea-Klapp, A. F. Arroyo-Avirama, S. Ormazabal-Latorre, N. F. Gajardo-Parra, C. Pazo-Carballo, H. Quinteros-Lama, T. Marzialetti, C. Held, R. I. Canales, J. M Garrido |
Separation of furfuryl alcohol from water using hydrophobic deep eutectic solvents |
J. Mol. Liq. 384 (2023) 122232 |
|
Research Area: II
|
|
J. Wang, A. A. Nikolayev, J. H. Marks, M. Mcanally, V. N. Azyazov, A. K. Eckhardt, A. M. Mebel, R. I. Kaiser |
Quantum Tunneling Mediated Low-Temperature Synthesis of Interstellar Hemiacetals |
J. Phys. Chem. Lett. 14 (2023) 6078-6085 |
|
Research Area: III
|
|
J. Wang, A. A. Nikolayev, C. Zhangab, J. H. Marks, V. N. Azyazovd, A. K. Eckhardt, A. M. Mebel, R. I. Kaiser |
Synthesis of Interstellar Propen-2-ol (CH3C(OH)CH2)-The Simplest Enol Tautomer of a Ketone |
Phys. Chem. Chem. Phys 25 (2023) 17460-17469 |
|
Research Area: II
|
|
F. Otte, J. Kleinheider, B. Grabe, W. Hiller, F. Busse, R. Wang, N. M. Kreienborg, C. Merten, U. Englert, C. Strohmann |
Gauging the Strength of the Molecular Halogen Bond via Experimental Electron Density and Spectroscopy |
ACS Omega 8 (2023) 21531-21539 |
|
Research Area: I
|
|
C. Grassin, C. Merten |
Matrix-isolation vibrational circular dichroism (VCD) spectroscopy of chiral 1-phenyl-1-propanol |
Phys. Chem. Chem. Phys. 25 (2023) 17107-17111 |
|
Research Area: III
|
|
C. Bertram, C. Zaum, W. Fang, A. Michaelides, K. Morgenstern |
Considerably Increased Dynamics of CO-Water Complexes over CO and Water Alone |
Nano Lett. 23 (2023) 4793-4799 |
|
Research Area: I
|
|
S.-H. Yoo, M. Todorova, J. Neugebauer, C. G. Van de Walle |
Microscopic Origin of Polarization Charges at Ga N/ (Al, Ga) N Interfaces |
Phys. Rev. Appl. 19 (2023) 64037 |
|
Research Area: I
|
|
L. Meneses, N. F. Gajardo-Parra, E. Cea-Klapp, J. Matias Garrido, C. Held, A. R.Duarte, A. Paiva |
Improving the activity of horseradish peroxidase in betaine-based natural deep eutectic systems |
RSC Sustain. 1 (2023) 886-897 |
|
Research Area: III
|
|
A. F. Arroyo-Avirama, S. Carreno-Guzman, J. Lorenzo-Llanes, N. F. Gajardo-Parra, R. Santiago, C. Held, J. Palomar, R. I. Canales |
In Situ Product Recovery of beta-Ionone from a Fermentation Broth: Computational Solvent Selection and Process Design of Its Extraction and Purification |
ACS Sustain. Chem. Eng. 11 (2023) 9065-9076 |
|
Research Area: II
|
|
J. F. Rowen, F. Beyer, T. Schleif, W. Sander |
Isomer-Specific Heavy-Atom Tunneling in the Ring Expansion of Fluorenylazirines |
J. Org. Chem. 88 (2023) 7893-7900 |
|
Research Area: III
|
|
R. Dec, M. W. Jaworek, W. Dzwolak, R. Winter |
Liquid-Droplet-Mediated ATP-Triggered Amyloidogenic Pathway of Insulin-Derived Chimeric Peptides: Unraveling the Microscopic and Molecular Processes |
J. Am. Chem. Soc. 145 (2023) 4177-4186 |
|
Research Area: III
|
|
J. Rocker, J. A. Dresel, L. A. Krieger, P. Eckhardt, A. M. Ortuno, W. R. Kitzmann, G. H. Clever, K. Heinze, T. Opatz |
Substitution Effects on the Photophysical and Photoredox Properties of Tetraaza[7]helicenes |
Chem. Eur. J. 29 (2023) e202301244 |
|
Research Area: II
|
|
A. M. T. Muthig, J. Wieland, C. Lenczyk, S. Koop, J. Tessarolo, G. H. Clever, B. Hupp, A. Steffen |
Towards Fast Circularly Polarized Luminescence in 2-Coordinate Chiral Mechanochromic Copper(I) Carbene Complexes |
Chem. Eur. J. 29 (2023) e202300946 |
|
Research Area: II
|
|
K. Exner |
Combining Descriptor-Based Analyses and Mean-Field Modeling of the Electrochemical Interface to Comprehend Trends of Catalytic Processes at the Solid/Liquid Interface |
J. Energy Chem. 85 (2023) 288-290 |
|
Research Area: I
|
|
M. Sokolov, Y. A. Mastrikov, G. Zvejnieks, D. Bocharov, V. Krasnenko, K. S. Exner, E. A. Kotomin |
First Principles Calculations of Hydrogen Evolution Reactionand Proton Migration on Stepped Surfaces of SrTiO3 |
Adv. Theory Simul. 6 (2023) 2200619 |
|
Research Area: I
|
|
K. S. Exner |
Toward data- and mechanistic-driven volcano plots in electrocatalysis |
Electrochem. Sci. Adv 3 (2023) 01. Jul |
|
Research Area: I
|
|
J. T. Metternich, J. A. C. Wartmann, L. Sistemich, R. Nissler, S. Herbertz, S. Kruss |
Near-Infrared Fluorescent Biosensors Based on Covalent DNA Anchors |
J. Am. Chem. Soc 145 (2023) 14776-14783 |
|
Research Area: I
|
|
B. List, J. T. Han, H. Zhou |
Bronsted Acid Catalyzed Asymmetric Silylation of Biaryl Diols |
Synlett 34 (2023) A-C |
|
Research Area: II
|
|
R. H. Gaonkar, Y. T. Schmidt, R. Mansi, Y. Almeida-Hernandez, E. Sanchez-Garcia, M. Harms, J. Muench, M. Fani |
Development of a New Class of CXCR4-Targeting Radioligands Based on the Endogenous Antagonist EPI-X4 for Oncological Applications |
J. Med. Chem. 66 (2023) 8484-8497 |
|
Research Area: II
|
|
A. Portela-Gonzalez,E. Mendez-Vega,W. Sander |
2, 3, 5, 6-Tetrafluoro-1, 4-phenylenedinitrene: a Dinitrene with Near Degenerate Singlet and Triplet States |
J. Phys. Org. Chem. 36 (2023) e4544 |
|
Research Area: II
|
|
B. Hill, S. Abraham, A. Akhtar, G. Selvaggio, K. Tschulik, S. Kruss |
Surfactant Assisted Exfoliation of Near Infrared Fluorescent Silicate Nanosheets |
RSC Adv. 13 (2023) 20916-20925 |
|
Research Area: I
|
|
S. J. Goettl, Z. Yang, S. Kollotzek, D. Paul, R. I. Kaiser, A. Somani, A. Portela-Gonzalez, W. Sander, A. A. Nikolayev, V. N. Azyazov, A. M. Mebel |
Exploring the Chemical Dynamics of Phenylethynyl Radical (C6H5CC, X2A1) Reactions with Allene (H2CCCH2, X1A1) and Methylacetylene (CH3CCH, X1A1) |
J. Phys. Chem. A 127 (2023) 5723-5733 |
|
Research Area: II
|
|
M. Harms, N. Smith, M. Huan, R. Gross, P. von Maltitz, C. Stuerzel, Y. B. Ruiz-Blanco, Y. Almeida-Hernandez, A. Rodriguez-Alfonso, D. Cathelin, B. Caspar, B. Tahar, S. Sayettat, N. Bekaddour, K. Vanshylla, F. Kleipass , S. Wiese, L. Staendker, F. Klein, B. Lagane, A. Boonen, D. Schols, S. Benichou, E. Sanchez-Garcia, J. P. Herbeuval, J. Muench |
Spermine and spermidine bind CXCR4 and inhibit CXCR4- but not CCR5-tropic HIV-1 infection |
Sci. Adv. 9 (2023) eadf8251 |
|
Research Area: II
|
|
J. Neblik, A. Kirupakaran, C. Beuck, J. Mieres-Perez, F. Niemeyer, M.-H. Le, U. Telgheder, J. F. Schmuck, A. Dudziak, P. Bayer, E. Sanchez-Garcia, S. Westermann, T. Schrader |
Multivalent Molecular Tweezers Disrupt the Essential NDC80 Interaction with Microtubules |
J. Am. Chem. Soc 145 (2023) 15251-15264 |
|
Research Area: II
|
|
H. Singh, C. K. Das, B. Buchmuller, L. V. Schaefer, D. Summerer, R. Linser |
Epigenetic CpG duplex marks probed by an evolved DNA reader via a well-tempered conformational plasticity |
Nucleic Acids Res. 51 (2023) 6495-6506 |
|
Research Area: I
|
|
C. Mueller, C. Merten |
Solvation of serine-based model peptides and the role of the intramolecular OH-O hydrogen bond in interpreting VCD spectra |
Phys. Chem. Chem. Phys 25 (2023) 19462-19469 |
|
Research Area: II
|
|
A. Soleimani, H. J. Risselada |
Pure Graphene Acts as an Entropic Surfactant at the Octanol-Water Interface |
ACS Nano 17 (2023) 13554-13562 |
|
Research Area: I
|
|
K. S. Exner |
How data-driven approaches advance the search for materials relevant to energy conversion and storage |
Mater. Today Energy 36 (2023) 101364 |
|
Research Area: II
|
|
S. Brunen, B. Mitschke, M. Leutzsch, B. List |
Asymmetric Catalytic Friedel-Crafts Reactions of Unactivated Arenes |
J. Am. Chem. Soc 145 (2023) 15708-15713 |
|
Research Area: II
|
|
S. Timmermann, N. Das Anthuparambil, A. Girelli, N. Begam, M. Kowalski, S. Retzbach, M. D. Senft, M. S. Akhundzadeh, H.-F. Poggemann, M. Moron, A. Hiremath, D. Gutmueller, M. Dargasz, O. Oeztuerk, M. Paulus, F. Westermeier, M. Sprung, A. Ragulskaya, F. Zhang, F. Schreiber, C. Gutt |
X-ray driven and intrinsic dynamics in protein gels |
Sci. Rep. 13 (2023) 11048 |
|
Research Area: III
|
|
I. Regeni, R. Chowdhury, K. Terlinden, S. Horiuchi, J. J. Holstein, S. Feldmann, G. H. Clever |
Engineering Soluble Diketopyrrolopyrrole Chromophore Stacks from a Series of Pd(II)-based Ravels |
Angew. Chem. Int . Ed. 62 (2023) e202308288 |
|
Research Area: II
|
|
F. Espinoza-Cartagena,S. Ormazabal-Latorre,C. Pazo-Carballo,?N. F. Gajardo-Parra,?G. A. Nunez,?J. Matias Garrido,?E. Cea-Klapp,?R. Santiago,?C. Held, R. I. Canales |
Separation of Isoeugenol from Methylcyclohexane as a Model Mixture of Biojet Fuel Purification: Solvent Selection and Liquid-Liquid Equilibrium |
Ind. Eng. Chem. Res. 62 (2023) 12006-12020 |
|
Research Area: II
|
|
Y. Cao, J. Mieres-Perez, J. F. Rowen, E. Sanchez-Garcia, W. Sander, K. Morgenstern |
Chirality control of a single carbene molecule by tip-induced van der Waals interactions |
Nat. Commun. 14 (2023) 4500 |
|
Research Area: III
|
|
M. Teucher,S. Kucher,M. H.Timachi,C. Blake Wilson,?D. Smilowicz,?R. Stoll,?N. Metzler-Nolte,?M. S. Sherwin,?S. Han, E. Bordignon |
Spectroscopically Orthogonal Spin Labels in Structural Biology at Physiological Temperatures |
J. Phys. Chem. B 127 (2023) 6668-6674 |
|
Research Area: I
|
|
S. Ntim, M. Sulpizi |
Molecular dynamics simulations of electrified interfaces including the metal polarisation |
Phys. Chem. Chem. Phys 25 (2023) 22541-23320 |
|
Research Area: I
|
|
S. Ruiz-Barragan, H. Forbert, D. Marx |
Anisotropic Pressure Effects on Nanoconfined Water within Narrow Graphene Slit Pores |
Phys. Chem. Chem. Phys. 25 (2023) 28119-28129 |
|
Research Area: III
|
|
B. Xue, J. Shen, S. Manna, A. Doppiu, L. J. Goossen |
Selective Monoarylation of Ammonium Triflate with Aryl Chlorides Catalyzed by [Pd (beta-MeNAP) Br] 2 and AdBrettPhos |
Adv. Synth. Catal. 365 (2023) 1-6 |
|
Research Area: II
|
|
V. Drabkin, V. Paczelt, A. K. Eckhardt |
Spectroscopic identification of interstellar relevant 2-iminoacetaldehyde |
Chem. Commun. 59 (2023) 12715-12718 |
|
Research Area: III
|
|
T. Guseva, P. Gerschel, D. Siegmund, U.-P. Apfel |
Synthesis and Electrochemical Investigation of Phosphine Substituted Diiron Phosphadithiolate Complexes |
Eur. J. Inorg. Chem. 26 (2023) e202300470 |
|
Research Area: I
|
|
K. S. Exner |
On the Importance of the Volcano Slope and Mechanistic Pathways to Comprehend Activity and Selectivity Trends in Electrocatalysis |
ECS Trans. 112 (2023) 399-403 |
|
Research Area: I
|
|
H. Kuntrapakam, A. B. Grommet, M. J. Bialek, J. Wang, O. Yanshyna, Y. Diskin-Posner, G. H. Clever, R. Klajn |
Guest Encapsulation Alters the Thermodynamic Landscape of a Coordination Host |
J. Am. Chem. Soc 145 (2023) 24755-24764 |
|
Research Area: II
|
|
P. Aravena, E. Cea-Klapp, N. F. Gajardo-Parra, C. Held, J. Matias Garrido, R. I. Canales |
Effect of water and hydrogen bond acceptor on the density and viscosity of glycol-based eutectic solvents |
J. Mol. Liq. 389 (2023) 122856 |
|
Research Area: I
|
|
S. Ramos, J. Kamps, S. Pezzotti, K. F. Winklhofer, J. Tatzelt, M. Havenith |
Hydration makes a difference! How to tune protein complexes between liquid-liquid and liquid-solid phase separation |
Phys. Chem. Chem. Phys. 25 (2023) 28063-28069 |
|
Research Area: I
|
|
X. Gong, R. K. Campen, Y. Tong |
Direct observation of the potential dependent protonation of 4-(Dimethylamino) pyridine on gold electrodes |
J. Phys. Chem. C 127 (2023) 16615-16622 |
|
Research Area: I
|
|
D. Pal, T. Steinke, L. Vogel, E. Engelage, S. Heinrich, D. Kutzinski, S. Huber |
A combined halogen- and chalcogen-bonding organocatalyst |
Adv. Synth. Catal. 365 (2023) 2718-2723 |
|
Research Area: II
|
|
J. Joekel, E. B. Boydas, J. Wellauer, O. S. Wenger, M. Robert, M. Roemelt, U. P. Apfel |
A CuICoII-cryptate for the visible light-driven reduction of CO2 |
Chem. Sci. 14 (2023) 12774-12783 |
|
Research Area: II
|
|
C. M. Clausen, O. A. Krysiak, L. Banko, J. K. Pedersen, W. Schuhmann, A. Ludwig, J. Rossmeisl |
A Flexible Theory for Catalysis: Learning Alkaline Oxygen Reduction on Complex Solid Solutions within the Ag-Pd-Pt-Ru Composition Space |
Angew. Chem.Int. Ed 62 (2023) e2023071 |
|
Research Area: II
|
|
J. M. Holthoff, E. Engelage, A. Ruff, L. Galazzo, E. Bordignon, S. M. Huber, R. Weiss |
A Potent Auto-Umpolung Ligand for Conjugative Radical Stabilization |
Chem. Eur. J. 29 (2023) e202203149 |
|
Research Area: II
|
|
C. J. Bondue, M. T. M. Koper, K. Tschulik |
A Versatile and Easy Method to Calibrate a Two-Compartment Flow Cell for Differential Electrochemical Mass Spectrometry Measurements |
ACS Meas. Sci. Au 3 (2023) 277-286 |
|
Research Area: I
|
|
T. W. Ko, J. A. Finkler, S. Goedecker, J. Behler |
Accurate Fourth-Generation Machine Learning Potentials by Electrostatic Embedding |
J. Chem. Theory Comput. 19 (2023) 3567-3579 |
|
Research Area: I
|
|
G. Yu, N. F. Gajardo-Parra, M. Chen, B. Chen, G. Sadowski, C. Held |
Aromatic volatile organic compounds absorption with phenyl-based deep eutectic solvents: A molecular thermodynamics and dynamics study |
AIChE J 69 (2023) e18053 |
|
Research Area: I
|
|
K. S. Stroh, P. C. T. Souza, L. Monticelli, H. J. Risselada |
CGCompiler: Automated coarse-grained molecule parameterization via noise-resistant mixed-variable optimization |
J. Chem. Theory Comput. 19 (2023) 8384-8400 |
|
Research Area: I
|
|
H. Lv, X. P. Zhang, K. Guo, J. Han, H. Guo, H. Lei, X. Li, W. Zhang, U.-P. Apfel, R. Cao |
Coordination Tuning of Metal Porphyrins for Improved Oxygen Evolution Reaction |
Angew. Chem. Int . Ed. 62 (2023) e202305938 |
|
Research Area: II
|
|
J. Loeffler, S. M. P. Vanden Broeck, C. S. J. Cazin, S. P. Nolan, V. H. Gessner |
Correlation of Experimental and Calculated Reaction Enthalpies with Ligand Donor Strengths |
Chem.Eur. J. 29 (2023) e2023001 |
|
Research Area: II
|
|
J. T. Kleinhaus, J. Wolf, K. Pellumbi, L. Wickert, S. C. Viswanathan, K. J. Puring, D. Siegmund, U.-P. Apfel |
Developing electrochemical hydrogenation towards industrial application |
Chem. Soc. Rev. 52 (2023) 7305-7332 |
|
Research Area: II
|
|
M. Harms, R. Fabech Hansson, A. Gilg, Y. Almeida-Hernandez, J. Loeffler, A. Rodriguez-Alfonso, M. M. W. Habib, D. Albers, N. S. Ahmed, A. H. Abadi, G. Winter, V. Rasche, A. J.Beer, G. Weidinger, N. Preising, L. Staendker, S. Wiese, E. Sanchez-Garcia, A. N.Zelikin, J. Muench |
Development of N-Terminally Modified Variants of the CXCR4-Antagonistic Peptide EPI-X4 for Enhanced Plasma Stability |
J. Med. Chem. 66 (2023) 15189-15204 |
|
Research Area: II
|
|
F. M. Harvey, A. H. Heidecker, C. Merten, T. Bach |
Diastereoselective, Lewis acid-mediated Diels-Alder reactions of allenoic acid derivatives and 1,3-cyclopentadienes |
Org. Biomol. Chem. 21 (2023) 4422-4428 |
|
Research Area: II
|
|
V. Anh Tran, M. Teucher, L. Galazzo, B. Sharma, T. Pongratz, S. M. Kast, D. Marx, E. Bordignon, A. Schnegg, F. Neese |
Dissecting the Molecular Origin of g-Tensor Heterogeneity and Strain in Nitroxide Radicals in Water: Electron Paramagnetic Resonance Experiment versus Theory |
J. Phys. Chem. A 127 (2023) 6447-6466 |
|
Research Area: III
|
|
M. Kondratiuk, D. Gopinath, A. Elrrays, L. J. Goossen |
Double-Bond Isomerization of Rapeseed Oil Methyl Esters in a Continuous Flow Reactor Efficiently Catalyzed by H-Mordenite |
Eur. J. Lipid Sci. Technol. 125 (2023) 2200163 |
|
Research Area: II
|
|
C. J. Bondue, M. Spallek, L. Sobota, K. Tschulik |
Electrochemical Aldehyde Oxidation at Gold Electrodes: gem-Diol, non-Hydrated Aldehyde, and Diolate as Electroactive Species |
ChemSusChem 16 (2023) e202300685 |
|
Research Area: I
|
|
A. Gulzar, J. Noetzel, H. Forbert, D. Marx |
Elucidating the Self-cleavage Dynamics of Hairpin Ribozyme by Mode-decomposed Infrared Spectroscopy |
J. Chem. Phys. Lett. 14 (2023) 7940-7945 |
|
Research Area: I
|
|
D. Sowa Prendes, F. Papp, N. Sankaran, N. Sivendran, F. Beyer, C. Merten, L. J. Goossen |
Enantioselective Synthesis of Arylglycines via Pd-Catalyzed Coupling of Schoellkopf Bis-Lactim Ethers with Aryl Chlorides |
Angew. Chem.Int. Ed. 62 (2023) e202309868 |
|
Research Area: II
|
|
M. de Robichon, T. Kratz, F. Beyer, J. Zuber, C. Merten, T. Bach |
Enantioselective, Intermolecular [pi2+ sigma2] Photocycloaddition Reactions of 2 (1 H)-Quinolones and Bicyclo [1.1.0] butanes |
J. Am. Chem. Soc. 145 (2023) 24466-24470 |
|
Research Area: II
|
|
T. Ockelmann, C. Hoberg, A. Buchmann, F. Novelli, M. Havenith |
Energy Dissipation into the Solvent during Proton Transfer Occurs via Acoustic Phonons |
J. Phys. Chem. B. 44 (2023) 9560-9565 |
|
Research Area: I
|
|
N. D. Anthuparambil, A. Girelli, S. Timmermann, M. Kowalski, M. S. Akhundzadeh, S. Retzbach, M. D. Senft, M. Dargasz, D. Gutmueller, A. Hiremath, M. Moron, Oe. Oeztuerk, H. F. Poggemann, A. Ragulskaya, N. Begam, A. Tosson, M. Paulus, F. Westermeier, F. Zhang, M. Sprung, F. Schreiber, C. Gutt |
Exploring non-equilibrium processes and spatio-temporal scaling laws in heated egg yolk using coherent X-rays |
Nat. Commun. 14 (2023) 5580 |
|
Research Area:
|
|
J. Loeffler, V. H. Gessner |
From a Fluorenyl Substituted Ylide-Functionalized Phosphine to a Neutral Phosphide via P-C Bond Cleavage |
ChemPlusChem 88 (2023) e202200459 |
|
Research Area: II
|
|
S. Bag, S. Pezzotti, D. Das Mahanta, S. Schulke, G. Schwaab, M. Havenith |
From Local Hydration Motifs in Aqueous Acetic Acid Solutions to Macroscopic Mixing Thermodynamics: A Quantitative Connection from THz-Calorimetry |
J. Phys. Chem. B 127 (2023) 9204-9210 |
|
Research Area: I
|
|
A. Walther, I. Regeni, J. Holstein, G. Clever |
Guest-Induced Reversible Transformation between an Azulene-Based Pd2L4 Lantern-Shaped Cage and a Pd4L8 Tetrahedron |
J. Am. Chem. Soc. 145 (2023) 25365-25371 |
|
Research Area: II
|
|
M. Prado Merini, T. Schleif, W. Sander |
Heavy-Atom Tunneling in Bicyclo 4.1.0 hepta-2,4,6-trienes |
Angew. Chem. Int . Ed. 62 (2023) e202309717 |
|
Research Area: III
|
|
L. Iffland-Muelhaus, B. Battistella, D. Siegmund, K. Ray, U.-P. Apfel |
How ligand geometry affects the reactivity of Co (II) cyclam complexes |
Eur. J. Inorg. Chem. 26 (2023) e202300418 |
|
Research Area: II
|
|
N. F. Gajardo-Parra, G. Rodriguez, A. F. Arroyo-Avirama, A. Veliju, T. Happe, R. I. Canales, G. Sadowski, C. Held |
Impact of Deep Eutectic Solvents on Kinetics and Folding Stability of Formate Dehydrogenase |
Processes 11 (2023) 2815 |
|
Research Area: III
|
|
J. Cho, T. Lim, H. Kim, L. Meng, J. Ki, S. Lee, J. Hoon Lee, G. Yeong Jung, K. Seung Lee, F. Vines, F. Illas, K. S. Exner, S. Hoon Joo, C. Hyuck Cho |
Importance of broken geometric symmetry of single-atom Pt sites for efficient electrocatalysis |
Nat. Commun. 14 (2023) 3233 |
|
Research Area: I
|
|
C. Kling, A. Sommer, Y. Almeida Hernandez, J. A. Perez-Erviti, R. Bhadane, L. Staendker, S. Wiese, H. Barth, M. Pupo-Merino, A .T. Pilliainen, E. Sanchez-Garcia, K. Ernst |
Inhibition of Pertussis Toxin by Human alpha-Defensins-1 and -5: Differential Mechanisms of Action |
Int. J. Mol. Sci. 24 (2023) 10557 |
|
Research Area: II
|
|
T. O. Peulen, C. S. Hengstenberg, R. Biehl, M. Dimura, C. Lorenz, A. Valeri, J. Folz, C. A. Hanke, S. Ince, T. Voepel, B. Farago, H. Gohlke, J. P. Klare, A. M. Stadler, C. A. M. Seidel, C. Herrmann |
Integrative dynamic structural biology unveils conformers essential for the oligomerization of a large GTPase |
eLife 12 (2023) e79565 |
|
Research Area: I
|
|
V. S. V. S. N. Swamy, F. Krischer, C. Schwarz, H. Steinert, B. Mallick, V. H. Gessner |
Inverting the Electronic Structure of Diylidylgermylenes by Backbone Modification |
Chem. Eur. J. 29 (2023) e202300504 |
|
Research Area: II
|
|
J. Stoesser, E. Engelage, D. Belmonte, S. M. Huber |
Just at the limit: binding studies with neutral brominated terphenyl-derived halogen bond donors |
Cryst. Eng. Comm 25 (2023) 1501-1506 |
|
Research Area: II
|
|
C. Jhe Liao, Y. Ting Tseng , Y. An Cheng, L. A. Dayao, L. Iffland-Muehlhaus, L. B. Gee, R. D. Ribson, T. Shan Chan, U.-P. Apfel, T. Te Lu |
Ligand Control of Dinitrosyl Iron Complexes for Selective Superoxide-Mediated Nitric Oxide Monooxygenation and Superoxide?Dioxygen Interconversion |
J. Am. Chem. Soc 145 (2023) 20389-20402 |
|
Research Area: II
|
|
D. Das Mahanta, D. Robinson Brown, S. Pezzotti, S. Han, G. Schwaab, M. Scott Shell, M. Havenith |
Local solvation structures govern the mixing thermodynamics of glycerol?water solutions |
Chem. Sci. 14 (2023) 7381-7392 |
|
Research Area: I
|
|
M. Rybarski, D. Mrohs, K. Osenberg, M. Hemmersbach, K. Pfeffel, J. Steinkamp, D. Schmidt, K. Violou, R. Schaening, K. Schmidtke, V. Bader, M. Andriske, P. Bohne, M. D. Mark, K. F. Winklhofer, H. Luebbert, X. Ran Zhu |
Loss of parkin causes endoplasmic reticulum calcium dyshomeostasis by upregulation of reticulocalbin 1 |
Eur. J. Neurosci. 57 (2023) 739-761 |
|
Research Area: I
|
|
F. Brieuc, C. Schran, D. Marx |
Manifestations of Local Supersolidity of 4He around a Charged Molecular Impurity |
Phys. Rev. Res. 5 (2023) 043083 |
|
Research Area: I
|
|
D. Tetzlaff, T. Rensch, L. Messing, P. Banke, S. Graetz, D. Siegmund, L. Borchardt, U.-P. Apfel |
Mechanochemical one-pot synthesis of heterostructured pentlandite-carbon composites for the hydrogen evolution reaction |
Chem. Sci. 14 (2023) 11790-11797 |
|
Research Area: II
|
|
C. Merten |
Modelling solute-solvent interactions in VCD spectra analysis with the micro-solvation approach |
Phys. Chem. Chem. Phys 25 (2023) 29404-29414 |
|
Research Area: I
|
|
A. M. Stingel, J. Leemans, Z. Hens, P. Geiregat, P. B. Petersen |
Narrow homogeneous linewidths and slow cooling dynamics across infrared intra-band transitions in n-doped HgSe colloidal quantum dots |
J. Chem. Phys. 158 (2023) 114202 |
|
Research Area: I
|
|
M. Merko, S. Delsing, G. W. Busser, M. Muhler |
Non-oxidative dehydrogenation of methanol to formaldehyde over supported GaOx-based catalysts |
J. Catal. 427 (2023) 115111 |
|
Research Area: II
|
|
A. Erbe, M. F. Tesch, O. Ruediger, B. Kaiser, S. DeBeer, M. Rabe |
Operando studies of Mn oxide based electrocatalysts for oxygen evolution reaction |
Phys. Chem. Chem. Phys 25 (2023) 26958-26971 |
|
Research Area: I
|
|
A. Burhenn, R.Bavaro, V. H. Gessner |
Pd-catalysed hydrodehalogenation of aryl chlorides: a mild method for deuteration and detoxification |
Catal. Sci. Technol. 13 (2023) 3545-3550 |
|
Research Area: II
|
|
M. Saraswat, A. Portela-Gonzalez, G. Karir, E. Mendez-Vega, W. Sander, P. Hemberger |
Photoelectron spectroscopic study of 2-naphthylnitrene and its thermal rearrangement to cyanoindenes |
Phys. Chem. Chem. Phys. 25 (2023) 31146-31152 |
|
Research Area:
|
|
S. Lapointe, P. Duari, V. H. Gessner |
Probing the donor strength of yldiide ligands: synthesis, structure and reactivity of rhodium complexes with a PCylideN pincer ligand |
Chem. Sci. 14 (2023) 3816-3825 |
|
Research Area: II
|
|
A. Eitzinger, J. Reitz, P. W. Antoni, H. Mayr, A. R. Ofial, M. M. Hansmann |
Pushing the Upper Limit of Nucleophilicity Scales by Mesoionic N-Heterocyclic Olefins |
Angew. Chem. Int. Ed. 62 (2023) e202309790 |
|
Research Area: II
|
|
I. Simko, C. Schran, F. Brieuc, C. Fabri, O. Asvany, S. Schlemmer, D. Marx, A. Geza Csaszar |
Quantum nuclear delocalization and its rovibrational fingerprints |
Angew. Chem. Int. Ed. 62 (2023) e202306744 |
|
Research Area: I
|
|
E. Batsa Tetteh, M. Kim, A. Savan, A. Ludwig, T. Dong Chung, W. Schuhmann |
Reassessing the intrinsic hydrogen evolution reaction activity of platinum using scanning electrochemical cell microscopy |
Cell Rep. Phys. Sci. 4 (2023) 101680 |
|
Research Area: I
|
|
F. Krischer, M. Joerges, T. F. Leung, H. Darmandeh, V. H. Gessner |
Selectivity Control of the Ligand Exchange at Carbon in alpha-Metallated Ylides as Route to Ketenyl Anions |
Angew. Chem. Int . Ed. 62 (2023) e202309629 |
|
Research Area: II
|
|
M. B. Z. Hegazy, L. Bahri, D. Tetzlaff, S. A. Sanden, U. P. Apfel |
Silicon atom doping in heterotrimetallic sulfides for non-noble metal alkaline water electrolysis |
Energy Adv. 2 (2023) 1190-1203 |
|
Research Area: II
|
|
C. Ma, C. A. Schrage, J. Gretz, A.Akhtar, L. Sistemich, L. Schnitzler, H. Li, K. Tschulik, B. S. Flavel, S. Kruss |
Stochastic Formation of Quantum Defects in Carbon Nanotubes |
ACS Nano 17 (2023) 15989-15998 |
|
Research Area: I
|
|
C. Mueller, K. Scholten, E. Engelage, C. Merten |
Synthesis and VCD Spectroscopic Characterization of a Series of Azacryptands from a Chiral Valine-Based Derivative of Tris(2-aminoethyl)amine (TREN) |
Chem.Eur. J. 29 (2023) e202302126 |
|
Research Area: II
|
|
G. Hertrampf, S. Vojnovic, J. I. Mueller, C. Merten, J. Nikodinovic-Runic, T. A. M. Gulder |
Synthesis, Stereochemical Determination, and Antimicrobial Evaluation of Myxocoumarin A |
J. Org. Chem. 88 (2023) 14184-14188 |
|
Research Area: II
|
|
A. Mikula, M. Kubowicz, J. Mazurkow, K. Mars, M. Smialkowski, U.-P. Apfel, M. Radecka |
Tailoring the electrocatalytic activity of multicomponent (Co,Fe,Ni)9S8-xSex?pentlandite solid electrodes |
J. Mater. Chem. A 11 (2023) 7526-7538 |
|
Research Area: I
|
|
S. Mansourzadeh, T. Vogel, M. Shalaby, C. J. Saraceno? |
Temperature-Dependent THz Properties and Emission of Organic Crystal BNA |
Opt. Express 31 (2023) 29480-29490 |
|
Research Area: III
|
|
M. Saraswat, A. Portela-Gonzalez, G. Karir, E. Mendez-Vega, W. Sander, P. Hemberger |
Thermal Decomposition of 2- and 4-Iodobenzyl Iodide Yields Fulvenallene and Ethynylcyclopentadienes: A Joint Threshold Photoelectron and Matrix Isolation Spectroscopic Study |
J. Phys. Chem. A 127 (2023) 8574-8583 |
|
Research Area: II
|
|
S. Mukherjee, L. V. Schaefer |
Thermodynamic forces from protein and water govern condensate formation of an intrinsically disordered protein domain |
Nat. Commun. 14 (2023) 5892 |
|
Research Area: I
|
|
S. Mansourzadeh, T. Vogel, A. Omar, T. O. Buchmann, E. J. R. Kelleher, P. U. Jepsen, C. J. Saraceno |
Towards Intense Ultra-Broadband High Repetition Rate Terahertz Sources Based on Organic Crystals |
Opt. Mater. Express 13 (2023) 3287-3308 |
|
Research Area: I
|
|
A. Miako Tokita, J. Behler |
Tutorial: How to Train a Neural Network Potential |
J. Chem. Phys. 159 (2023) 121501 |
|
Research Area: I
|
|
T. M. Prass, P. Garidel, M. Blech, L. V. Schaefer |
Viscosity Prediction of High-Concentration Antibody Solutions with Atomistic Simulations |
J. Chem. Inf. Model. 63 (2023) 6129-6140 |
|
Research Area: III
|
|
L. Hoof, K. Pellumbi, S. Heuser, D. Siegmund, K. J. Puring, U.-P. Apfel |
Wassermanagement als Schluesselparameter fuer die Skalierung eines CO2-Elektrolyseurs |
Chem. Ing. Tech. 95 (2023) 668-674 |
|
Research Area: I
|
|
A. Ghiami-Shomami, C. Haettig |
Performance of the COSMO solvation model for photoacidity and basicity in water |
J Comput Chem. 44 (2023) 1913-1969 |
|
Research Area: I
|
|
C. Brocks, C. K. Das, J. Duan, S. Yadav, U.-P. Apfel, S. Ghosh, E. Hofmann, M. Winkler, V. Engelbrecht, L. V. Schaefer, T. Happe |
A Dynamic Water Channel Affects O2 Stability in [FeFe]-Hydrogenases |
ChemSusChem 17 (2023) e202301365 |
|
Research Area: II
|
|
C. J. Vonnemann, D. Bulfield, E. Engelage, S. Huber |
A Halogen Bonding Molecular Tweezer |
Org. Chem. Front. 10 (2023) 6146-6152 |
|
Research Area: II
|
|
D. Segets, C. Andronescu, U.-P. Apfel |
Accelerating CO2 electrochemical conversion towards industrial implementation |
Nat. Commun. 14 (2023) 7950 |
|
Research Area: II
|
|
J. Meng, H. Qin, H. Lei, X. Li, J. Fan, W. Zhang, U.-P. Apfel, R. Cao |
Adapting Synthetic Models of Heme/Cu Sites to Energy-Efficient Electrocatalytic Oxygen Reduction Reaction |
Angew. Chem. Int. Ed. 62 (2023) e202312255 |
|
Research Area: II
|
|
N. Jahmidi-Azizi, R. Oliva, R. Winter |
Alcohol-induced Conformational Changes and Thermodynamic Signatures in the Binding of Polyphenols to Proline-rich Salivary Proteins |
Chem. Eur. J. 29 (2023) e202302384 |
|
Research Area: I
|
|
A. Tortorella, R. Oliva, C. Giancola, L. Petraccone, R. Winter |
Bacterial model membranes under the harsh subsurface conditions of Mars |
Phys. Chem. Chem. Phys. 26 (2023) 760-769 |
|
Research Area: III
|
|
J. Peters, R. Oliva, A. Calio, P. Oger, R. Winter |
Effects of Crowding and Cosolutes on Biomolecular Function at Extreme Environmental Conditions |
Chem. Rev. 123 (2023) 13441-13488 |
|
Research Area: III
|
|
J. Thomas, J. Patwari, I. Langguth, C. Penschke, P. Zhou, K. Morgenstern, U. Bovensiepen |
Femtosecond electron transfer dynamics across the D2O/Cs+/Cu(111) interface: The impact of hydrogen bonding |
J. Phys. Chem. C 127 (2023) 2346-23474 |
|
Research Area: I
|
|
Y. Wang, T. Vogel, M. Khalili, S. Mansourzadeh, K. Hasse, S. Suntsov, D. Kip, C. J. Saraceno |
High-power intracavity single-cycle THz pulse generation using thin lithium niobate |
Optica 10 (2023) 1719-1722 |
|
Research Area: III
|
|
R. Loescher, V. Moreno, D. Adamou, D. K. Kesim, M. C. Schroeder, M. Clerici, J. P. Wolf, C. J. Saraceno |
High-power sub-picosecond filamentation at 1.03 micron with high repetition rates between 10 kHz and 100 kHz |
APL Photonics 8 (2023) 111303 |
|
Research Area: III
|
|
K. S. Exner |
Importance of the Walden Inversion for the Activity Volcano Plot of Oxygen Evolution |
Adv. Sci. 10 (2023) 2305505 |
|
Research Area: I
|
|
D. Corkery, A. Ursu, B. Lucas, M. Grigalunas, S. Kriegler, R. Oliva, R. Dec, S. Koska, A. Pahl, S. Sievers, S. Ziegler, R. Winter, Y. Wu, H. Waldmann |
Inducin Triggers LC3-Lipidation and ESCRT-Mediated Lysosomal Membrane Repair |
ChemBioChem 24 (2023) e202300579 |
|
Research Area: I
|
|
X. Luo, Z. Li, Y. Zheng, Y. Lin, H. Jiang, L. J. Goossen, M. Lei, L. Huang |
Ligand-Enabled-ortho-Arylation of (hetero)Aromatic Acids with 2,6-Disubstituted Aryl Halides |
ACS Catal. 13 (2023) 12104-12113 |
|
Research Area: II
|
|
C. Grassin, C. H. Pollok, N. M. Kreienborg, C. Merten |
Matrix effects in MI-VCD spectra of two chiral oxiranes and their potential microscopic origin |
Phys. Chem. Chem. Phys. 25 (2023) 31995-32001 |
|
Research Area: II
|
|
N. Furthmann, L. Angersbach, V. Bader, A. Blusch, S. Goel, A. Sanchez-Vicente, L. J. Krause, P. Grover, V. A. Trinkaus, E. M. van Well, M. Jaugstetter, K. Tschulik, R. Busk Damgaard, C. Saft, G. Ellrichmann, R. Gold, A. Koch, B. Englert, M. Glatzel, F. U. Hartl, K. Nakamura, C. W. Christine, E. J. Huang, J. Tatzelt, K. F. Winklhofer |
NEMO reshapes the protein aggregate interface and promotes aggrephagy by co-condensation with p62 |
Nat. Commun. 14 (2023) 8368 |
|
Research Area: III
|
|
P. Papadopoulou, R. van der Pol, N. van Hilten, W. L. van Os, R. Pattipeiluhu, G. Arias-Alpizar, R. A. Knol, W. Noteborn , M. A. Moradi, M. Joao Ferraz, J. M. F. G. Aerts, N. Sommerdijk, F. Campbell, H. J. Risselada, G. J. A. Sevink, A. Kros |
Phase-Separated Lipid-Based Nanoparticles: Selective Behavior At The Nano-Bio Interface |
Adv. Mater. 36 (2023) 2310872 |
|
Research Area: III
|
|
N. van Hilten, N. Verwei, J. Methorst, C. Nase, A. Bernatavicius, H. J. Risselada |
PMIpred: A physics-informed web server for quantitative Protein-Membrane Interaction prediction |
Bioinformatics 40 (2023) btae069 |
|
Research Area: I
|
|
K. Pellumbi, D. Krisch, C. Rettenmaier, H. Awada, H. Sun, L. Song,S. A . Sanden, L. Hoof, L. Messing, K. J. Puring, D. Siegmund, B. Roldan Cuenya, W. Schoefberger, U. P. Apfel |
Pushing the Ag-Loading of CO2-Electrolyzers to the Minimum via Molecularly Tuned Environments |
Cell Rep. Phys. Sci. 4 (2023) 101746 |
|
Research Area: I
|
|
J. Ackermann, E. Reger, S. Jung, J. Mohr, S. Herbertz, K. Seidl, S. Kruss |
Smart Slides for Optical Monitoring of Cellular Processes |
Adv. Funct. Mater. 34 (2023) 2309064 |
|
Research Area: I
|
|
A. Gunnarson, T. Quast, S. Dieckhoefer, N. Pfaender, F. Schueth, W. Schuhmann |
Stability Investigations on a Pt@HGS Catalyst as a Model Material for Fuel Cell Applications: The Role of the Local pH / Stabilitaetsuntersuchungen an einem Pt@HGS-Katalysator als Modellmaterial fuer Brennstoffzellenanwendungen: Die Rolle des lokalen pH-Wertes |
Angew. Chem. Int. Ed. 62 (2023) e202311780 |
|
Research Area: I
|
|
S. Remm, D. De Vecchis, J. Schoeppe, C. A. J. Hutter, I. Gonda, M. Hohl, S. Newstead, L. V. Schaefer, M. A. Seeger |
Structural basis for triacylglyceride extraction from mycobacterial inner membrane by MFS transporter Rv1410 |
Nat. Commun. 14 (2023) 6449 |
|
Research Area: I
|
|
S. L. Schumann, S. Kotnig, Y. Kutin, M. Drosou, L. M. Stratmann, Y. Streltsova, A. Schnegg, D. A. Pantazis, G. H. Clever, M. Kasanmascheff |
Structure and flexibility of copper-modified DNA G-quadruplexes investigated by 19F ENDOR at 34 GHz |
Chem. Eur. J. 29 (2023) e202302527 |
|
Research Area: II
|
|
P. Cignoni, P. Hosseini, C. Kaiser, O. Trost, D.-R. Nettler, L. Trzebiatowski, K. Tsculik |
Validating Electrochemical Active Surface Area Determination of Nanostructured Electrodes: Surface Oxide Reduction on AuPd Nanoparticles |
J. Electrochem. Soc. 170 (2023) 116505 |
|
Research Area: I
|
|
S. M. Piontek, E. Borguet |
Vibrational Spectroscopy of Geochemical Interfaces |
Surf. Sci. Rep. 78 (2023) 1000606 |
|
Research Area: III
|
|
J. L. Banuelos, E. Borguet, G. E. Brown Jr., R. T. Cygan, J. J DeYoreo, P. M. Dove, M. -P. Gaigeot, F. M. Geiger, J. M. Gibbs, V. H. Grassian, A. G. Ilgen, Y. -S. Jun, N. Kabengi, L. Katz, J. D. Kubicki, J. Luetzenkirchen, C. V. Putnis, R. C. Remsing, K. M. Rosso, G. Rother, M. Sulpizi, M. Villalobos, H. Zhang |
Oxide- and Silicate-Water Interfaces and Their Roles in Technology and the Environment |
Chem. Rev. 123 (2023) 6413-6544 |
|
Research Area: I
|
|
W. He, S. Chandra, T. Quast, S. Varhade, S. Dieckhoefer, J. R. C. Junqueira, H. Gao, S. Seisel, W. Schuhmann |
Enhanced nitrate-to-ammonia efficiency over linear assemblies of copper-cobalt nanophases stabilized by redox polymers |
Adv. Mater. 35 (2023) 2303050 |
|
Research Area: I
|
|
M. A. A. Mahbub, J. R. C. Junqueira, X. Wang, J. Zhang, S. Dieckhoefer, S. Seisel, D. Das, W. Schuhmann |
Dynamic transformation of functionalized bismuth to multi-phase active sites for CO2 reduction to formate at high current densities |
Adv. Funct. Mater. 33 (2023) 2307752 |
|
Research Area: II
|
|
D. Tetzlaff, V. Alagarasan, C. Simon, D. Siegmund, K. junge Puring, R. Marschall, U.-P. Apfel |
[NiFe]-(Oxy)Sulfides Derived from NiFe2O4 for the Alkaline Hydrogen Evolution Reaction |
Energies 15 (2022) 543 |
|
Research Area: I
|
|
A. Johnson, L. Iffland-Muehlhaus, J. Northcote-Smith, K. Singh, F. Ortu, U.-P. Apfel, K. Suntharalingam |
A bioinspired redox-modulating copper(ii) - macrocyclic complex bearing non-steroidal anti-inflammatory drugs with anti-cancer stem cell activity |
Dalton Trans. 51 (2022) 5904-5912 |
|
Research Area: I
|
|
J. Han, N. Wang, X. Li, H. Lei, Y. Wang, H. Guo, X. Jin, Q. Zhang, X. Peng, X.-P. Zhang, W. Zhang, U.-P. Apfel, R. Cao |
Bioinspired iron porphyrins with appended poly-pyridine/amine units for boosted electrocatalytic CO2 reduction reaction |
eScience 2 (2022) 623-631 |
|
Research Area: I
|
|
M. Barakat, Z. Hegazy, K. Harrath, D. Tetzlaff, M. Smialkowski, D. Siegmund, J. Li, R. Cao, U.-P. Apfel |
Boosting the overall electrochemical water splitting performance of pentlandites through non-metallic heteroatom incorporation |
iScience 25 (2022) 105148 |
|
Research Area: I
|
|
A. Gawel, T. Jaster, D. Siegmund, J. Holzmann, H. Lohmann, E. Klemm, U.-P. Apfel |
Electrochemical CO2 reduction - The macroscopic world of electrode design, reactor concepts & economic aspects |
iScience 25 (2022) 104011 |
|
Research Area: I
|
|
T. Jaster, A. Gawel, D. Siegmund, J. Holzmann, H. Lohmann, E. Klemm, U.-P. Apfel |
Electrochemical CO2 reduction toward multicarbon alcohols - The microscopic world of catalysts & process conditions |
iScience 25 (2022) 104010 |
|
Research Area: I
|
|
L. Hoof, N. Thissen, K, Pellumbi, K. junge Puring, D. Siegmund, A. Mechler, U.-P. Apfel |
Hidden parameters for electrochemical carbon dioxide reduction in zero-gap electrolyzers |
Cell. Rep. Phy. Sci. 3 (2022) 100825 |
|
Research Area: I
|
|
X. Li, B. Lv, X.-P. Zhang, X. Jin, K. Guo, D. Zhou, H. Bian, W. Zhang, U.-P. Apfel, R. Cao |
Introducing Water-Network-Assisted Proton Transfer for Boosted Electrocatalytic Hydrogen Evolution with Cobalt Corrole |
Angew. Chem. Int. Ed. 61 (2022) e202114310 |
|
Research Area: I
|
|
H. Lei, Q. Zhang, Z. Liang, H. Guo, Y. Wang, H. Lv, X. Li, W. Zhang, U.-P. Apfel, R. Cao |
Metal-Corrole-Based Porous Organic Polymers for Electrocatalytic Oxygen Reduction and Evolution Reactions |
Angew. Chem. Int. Ed. 61 (2022) e202201104 |
|
Research Area: I
|
|
K. Pellumbi, L. Wickert, J. T. Kleinhaus, J. Wolf, A. Leonard, D. Tetzlaff, R. Goy, J. A. Medlock, K. junge Puring, R. Cao, D. Siegmund, U.-P. Apfel |
Opening the pathway towards a scalable electrochemical semi-hydrogenation of alkynols via earth-abundant metal chalcogenides |
Chem. Sci. 13 (2022) 12461-12468 |
|
Research Area: I
|
|
K. Guo, X. Li, H. Lei, H. Guo, X. Jin, X.-P. Zhang, W. Zhang, U.-P. Apfel, R. Cao |
Role-Specialized Division of Labor in CO2 Reduction with Doubly-Functionalized Iron Porphyrin Atropisomers |
Angew. Chem. Int . Ed. 61 (2022) e202209602 |
|
Research Area: I
|
|
P. Gerschel, T. Guseva, D. Siegmund, U.-P. Apfel |
Synthesis and Characterization of Phosphorus-Containing Isocyclam Macrocycles and Their Nickel Complexes |
J. Org. Chem. 87 (2022) 16368-16377 |
|
Research Area: I
|
|
M. Senger, J. Duan, M. V. Pavliuk, U.-P. Apfel, M. Haumann, S. T. Stripp |
Trapping an Oxidized and Protonated Intermediate of the [FeFe]-Hydrogenase Cofactor under Mildly Reducing Conditions |
Inorg. Chem. 61 (2022) 10036-10042 |
|
Research Area: I
|
|
M. Smialkowski, D. Siegmund, K. Stier, L. Hensgen, M.-P. Checinski, U.-P. Apfel |
Trimetallic Pentlandites (Fe,Co,Ni)9S8 for the Electrocatalytical HER in Acidic Media |
ACS Mater. Au 2 (2022) 474-481 |
|
Research Area: I
|
|
Y. Wang, X.-P. Zhang, H. Lei, K. Guo, G. Xu, L. Xie, X. Li, W. Zhang, U.-P. Apfel, R. Cao |
Tuning Electronic Structures of Covalent Co Porphyrin Polymers for Electrocatalytic CO2 Reduction in Aqueous Solutions |
CCS Chem. 4 (2022) 2959-2967 |
|
Research Area: I
|
|
D. Krisch, H. Sun, K. Pellumbi, K. Faust, U.-P. Apfel, W. Schoefberger |
Tuning the Electronic Properties of Homoleptic Silver(I) bis-BIAN Complexes towards Efficient Electrocatalytic CO2 Reduction |
Catalysts 12 (2022) 545 |
|
Research Area: I
|
|
C. Bertram, D. P. Miller, C. Schunke, I. Kemeny, M. W. Kimura, U. Bovensiepen, E. Zurek, K. Morgenstern |
Interplay of Halogen and Weak Hydrogen Bonds in the Formation of Magic Nanoclusters on Surfaces |
J. Phys. Chem. B 126 (2022) 588-596 |
|
Research Area: I
|
|
G. Righi, J. Plescher, F. P. Schmidt, R. K. Campen, S. Fabris, A. K. Gericke, R. Schloegl, T. E. Jones, D. Teschner, S. Piccini |
On the origin of multihole oxygen evolution in haematite photoanodes |
Nat. Catal. 5 (2022) 888-899 |
|
Research Area: II
|
|
Y. Yue, G. Melani, H. Kirsch, A. Paarmann, P. Saalfrank, R. K. Campen, Y. Tong |
Structure and Reactivity of alpha-Al2O3 (0001) Surfaces: How Do Al-I and Gibbsite-like Terminations Interconvert? |
J. Phys. Chem. C 126 (2022) 13467-13476 |
|
Research Area: I
|
|
M. Rancan, J. Tessarolo, A. Carlotto, S. Carlotto, M. Rando, L. Barchi, E. Bolognesi, R. Seraglia, G. Bottaro, M. Casarin, G. H. Clever, L. Armelao |
Adaptive helicity and chiral recognition in bright Europium quadruple-stranded helicates induced by host-guest interaction |
Cell. Rep. Phy. Sci. 3 (2022) 100692 |
|
Research Area: II
|
|
S. Saha, Y.-T. Chen, S. Ganta, M. Gilles, B. Holzapfel, P. Lill, H. Rehage, C. Gatsogiannis, G. H. Clever |
Coordination cage-based emulsifiers: templated formation of metal oxide microcapsules monitored by in situ LC-TEM |
Chem. Eur. J. 28 (2022) e202103406 |
|
Research Area: II
|
|
S. Hasegawa, A. Baksi, B. Chen, G. H. Clever |
Guest Encapsulation Scope of a Triptycene-Based Pd2L4 Coordination Cage |
Org. Mater. 2 4 (2022) 222-227 |
|
Research Area: II
|
|
K. Wu, J. Tessarolo, A. Baksi, G. H. Clever |
Guest-modulated Circularly Polarized Luminescence by Ligand-to-Ligand Chirality Transfer in Heteroleptic Pd(II) Coordination Cages |
Angew. Chem. Int. Ed. 61 (2022) e202205725 |
|
Research Area: III
|
|
S. Ganta, C. Drechsler, Y.-T. Chen, G. H. Clever |
Nonaqueous Emulsion Polycondensation enabled by a Self-Assembled Cage-like Surfactant |
Chem. Eur. J. 28 (2022) e202104228 |
|
Research Area: II
|
|
S. Parzyszek, J. Tessarolo, A. Pedrazo-Tardajos, A. M. Ortuno, M. Baginski, S. Bals, G. H. Clever, W. Lewandowski |
Tunable Circularly Polarized Luminescence via Chirality Induction and Energy Transfer from Organic Films to Semiconductor Nanocrystals |
ACS Nano 16 (2022) 18472-18482 |
|
Research Area: I
|
|
S. K. Singh, N. F. Kleimeier, A .K. Eckhardt, R. I. Kaiser |
A Mechanistic Study on the Formation of Acetone (CH3COCH3), Propanal (CH3CH2CHO), Propylene Oxide (c-CH3CHOCH2) along with Their Propenol Enols (CH3CHCHOH/CH3C(OH)CH2) in Interstellar Analog Ices |
Astrophys. J. 941 (2022) 103 |
|
Research Area: II
|
|
K. S. Exner, A. Ivanova |
A doxorubicin-peptide-gold nanoparticle conjugate as a functionalized drug delivery system: exploring the limits |
Phys. Chem. Chem. Phys. 24 (2022) 14985 |
|
Research Area: II
|
|
K. S. Exner |
Beyond the thermodynamic volcano picture in the nitrogen reduction reaction over transition-metal oxides: Implications for materials screening |
Chinese J. Catal. 43 (2022) 2871-2880 |
|
Research Area: I
|
|
K. S. Exner, T. Lim, S. H. Joo |
Circumventing the OCl vs. OOH scaling relation in the chlorine evolution reaction: Beyond dimensionally stable anodes |
Curr. Opin. Electrochem. 34 (2022) 100979 |
|
Research Area: I
|
|
T. He, K. S. Exner |
Computational electrochemistry focusing on nanostructured catalysts: Challenges and opportunities |
Mater. Today Energy 28 (2022) 101083 |
|
Research Area: I
|
|
K. S. Exner |
Implications of the M-OO..OO-M recombination mechanism on materials screening and the oxygen evolution reaction |
J. Phys. Energy 5 (2022) 14008 |
|
Research Area: I
|
|
S. Razzaq, K. S. Exner |
Method to Determine the Bifunctional Index for the Oxygen Electrocatalysis from Theory |
ChemElectroChem 9 (2022) e202101603 |
|
Research Area: I
|
|
K. S. Exner |
On the Optimization of Nitrogen-Reduction Electrocatalysts: Breaking Scaling Relation or Catalytic Resonance Theory? |
Chem. Cat. Chem. 14 (2022) e202200366 |
|
Research Area: II
|
|
K. S. Exner |
On the optimum binding energy for the hydrogen evolution reaction: how do experiments contribute? |
Electrochem. Sci. Adv. 2 (2022) e2100101 |
|
Research Area: I
|
|
S. Razzaq, K. S.Exner |
Statistical analysis of breaking scaling relation in the oxygen evolution reaction |
Electrochim. Acta 412 (2022) 140125 |
|
Research Area: I
|
|
K. S. Exner |
Why the Microkinetic Modeling of Experimental Tafel Plots Requires Knowledge of the Reaction Intermediate?s Binding Energy |
Electrochem. Sci. Adv. 2 (2022) e2100037 |
|
Research Area: I
|
|
I. Rodstein, L. Kelling, J. Loeffler, T. Scherpf, A. Sarbajna, D. M. Andrada, V. H. Gessner |
Formation of exceptional monomeric YPhos-PdCl2 complexes with high activities in coupling reactions |
Chem. Sci. 13 (2022) 13552-13562 |
|
Research Area: II
|
|
J.-A. Zur, M. Schmidt, K.-S. Feichtner, P. Duari, J. Loeffler, T. Scherpf, V. H. Gessner |
From Stable PH-Ylides to alpha-Carbanionic Phosphines as Ligands for Zwitterionic Catalysts |
Angew. Chem. Int. Ed. 61 (2022) e202203950 |
|
Research Area: II
|
|
P. Neigenfind, D, Knyszek, J. Handelmann, V. H. Gessner |
Synthesis of sterically encumbered di- and triarylamines by palladium-catalysed C-N coupling reactions under mild reaction conditions |
Catal. Sci. Technol. 12 (2022) 3447-3453 |
|
Research Area: II
|
|
M. Joerges, F. Krischer, V. H. Gessner |
Transition metal-free ketene formation from carbon monoxide through isolable ketenyl anions |
Science 378 (2022) 1331-1336 |
|
Research Area: II
|
|
T. Stalder, F. Krischer, H. Steinert, P. Neigenfind, V. H. Gessner |
Ylide-Stabilized Phosphenium Cations: Impact of the Substitution Pattern on the Coordination Chemistry |
Chem. Eur. J. 28 (2022) e202104074 |
|
Research Area: II
|
|
S. Lapointe, A. Sarbajna, V. H. Gessner |
Ylide-Substituted Phosphines: A Platform of Strong Donor Ligands for Gold Catalysis and Palladium-Catalyzed Coupling Reactions |
Acc. Chem. Res. 55 (2022) 770-782 |
|
Research Area: II
|
|
X.-J. Wei, B. Xue, J. Handelmann, Z. Hu, H. Darmandeh, V. H. Gessner, L. J. Goossen |
Ylide-Functionalized Diisopropyl Phosphine (prYPhos): A Ligand for Selective Suzuki-Miyaura Couplings of Aryl Chlorides |
Adv. Synth. Catal. 364 (2022) 3336-3341 |
|
Research Area: II
|
|
A.-K. Seitz, T. van Lingen, M. Dyga, P. J. Kohlpaintner, S. R. Waldvogel, L. J. Goossen |
Amine Oxidation by Electrochemically Generated Peroxodicarbonate |
Synlett 15 (2022) 1860-3405 |
|
Research Area: I
|
|
J. F. Goebel, Z. Zeng, L. J. Goossen |
Biaryl Synthesis via Electrooxidative Transition Metal Catalyzed C-H Activation |
Synthesis 54 (2022) 565-569 |
|
Research Area: II
|
|
A.-K. Seitz, P. J. Kohlpaintner, T. van Lingen, M. Dyga, F. Sprang, M. Zirbes, S. R. Waldvogel, L. J. Goossen |
Concentrated Aqueous Peroxodicarbonate: Efficient Electrosynthesis and Use as Oxidizer in Epoxidations, S-, and N-Oxidations |
Angew. Chem. Int. Ed. 61 (2022) e202117563 |
|
Research Area: II
|
|
D. Lichte, N. Pirkl, G. Heinrich, S. Dutta, J. F. Goebel, D. Koley, L. J. Goossen |
Palladium-Catalyzed para-C-H Arylation of Anilines with Aromatic Halides |
Angew. Chem. Int. Ed. 61 (2022) e202210009 |
|
Research Area: II
|
|
N. Sivendran, F. Belitz, D. S. Prendes, A. M. Martinez, R. Schmid, L. J. Goossen |
Photochemical Sandmeyer-type Halogenation of Arenediazonium Salts |
Chem. Eur. J. 28 (2022) e202103669 |
|
Research Area: II
|
|
F. Belitz, A.-K. Seitz, J. F. Goebel, Z. Hu, L. J. Goossen |
Ru-Catalyzed C-H Arylation of Acrylic Acids with Aryl Bromides |
Org. Lett. 24 (2022) 3466-3470 |
|
Research Area: II
|
|
R. S. Tress, J. Liu, C. Haettig, S. Hoefener |
Pushing the limits: Efficient wavefunction methods for excited states in complex systems using frozen-density embedding |
J. Chem. Phys. 157 (2022) 204101 |
|
Research Area: I
|
|
H. Moon, R. P. Collanton, J. I Monroe, T. M. Casey, M. Scott Shell, S. Han, S. L. Scott |
Evidence for Entropically Controlled Interfacial Hydration in Mesoporous Organosilicas |
J. Am. Chem. Soc. 144 (2022) 1766-1777 |
|
Research Area: I
|
|
S. Jiao, D. M. Rivera Mirabal, A. J. DeStefano, R. A. Segalman, S. Han, M. Scott Shell |
Sequence Modulates Polypeptoid Hydration Water Structure and Dynamics |
Biomacromolecules 23 (2022) 1745-1756 |
|
Research Area: I
|
|
M. Heghmanns, A. Rutz, Y. Kutina, V. Engelbrecht, M. Winkler, T. Happe, M. Kasanmascheff |
The oxygen-resistant [FeFe]-hydrogenase CbA5H harbors an unknown radical signal |
Chem. Sci. 13 (2022) 7289-7294 |
|
Research Area: III
|
|
N. Suelzner, J. Haberhauer, C. Haettig , A. Hellweg |
Prediction of acid pKa values in the solvent acetone based on COSMO-RS |
J. Comput. Chem. 43 (2022) 1011-1022 |
|
Research Area: II
|
|
N. Suelzner, C. Haettig |
Theoretical Study on the Photoacidity of Hydroxypyrene Derivatives in DMSO Using ADC(2) and CC2 |
J. Phys. Chem. A 126 (2022) 5911-5923 |
|
Research Area: I
|
|
E. P. van Dam , B. Koenig , S. Ramos , E. M. Adams , G. Schwaab, M. Havenith |
Observation of dissipating solvated protons upon hydrogel formation |
Phys. Chem. Chem. Phys. 24 (2022) 27893-27899 |
|
Research Area: I
|
|
F. N. Bruenig, M. Rammler, E. M. Adams, M. Havenith, R. R. Netz |
Spectral signatures of excess-proton waiting and transfer-path dynamics in aqueous hydrochloric acid solutions |
Nat. Commun. 13 (2022) 4210 |
|
Research Area: I
|
|
S. Pezzotti, F. Sebastiani, E. P. van Dam, S. Ramos, V. Conti Nibali, G. Schwaab, M. Havenith |
Spectroscopic Fingerprints of Cavity Formation and Solute Insertion as a Measure of Hydration Entropic Loss and Enthalpic Gain |
Angew. Chem. Int. Ed. 61 (2022) e202203893 |
|
Research Area: I
|
|
F. Novelli , C. Hoberg , E. M. Adams , J. M. Klopf, M. Havenith |
Terahertz pump-probe of liquid water at 12.3 THz |
Phys. Chem. Chem. Phys. 24 (2022) 653-665 |
|
Research Area: I
|
|
S. Jaeger , P. Meyer , K.-S. Feichtner , S. Henkel , G. Schwaab , V. H. Gessner, M. Havenith |
Reaction of Lithium Hexamethyldisilazide (LiHMDS) with water at ultracold conditions |
Phys. Chem. Chem. Phys. 24 (2022) 24089-24094 |
|
Research Area: II
|
|
D. Mani, T. K. Roy, J. Khatri, G. Schwaab, S. Blach, C. Hoelzl, H. Forbert, D. Marx, M. Havenith |
Internal Electric Field-Induced Formation of Exotic Linear Acetonitrile Chains |
J. Phys. Chem. Lett. 13 (2022) 6852-6858 |
|
Research Area: I
|
|
S. Ruiz-Barragan, F. Sebastiani, P. Schienbein, J. Abraham , G. Schwaab , R. R. Nair, M. Havenith, D. Marx |
Nanoconfinement effects on water in narrow graphene-based slit pores as revealed by THz spectroscopy |
Phys. Chem. Chem. Phys. 24 (2022) 24734-24747 |
|
Research Area: I
|
|
K. Wonner, S. Murke, S. R. Alfarano, P. Hosseini, M. Havenith, K. Tschulik |
Operando electrochemical SERS monitors nanoparticle reactions by capping agent fingerprints |
Nano Res. 15 (2022) 4517-4524 |
|
Research Area: I
|
|
E. Cea-Klapp, N. Gajardo-Parra, P. Aravena, H. Quinteros-Lama, C. Held, R. I. Canales, J. Matias Garrido |
Interfacial Properties of Deep Eutectic Solvents by Density Gradient Theory |
Ind. Eng. Chem. Res. 61 (2022) 2580-2591 |
|
Research Area: III
|
|
N. F. Gajardo-Parra, L. Meneses, A. R. C. Duarte, A. Paiva, C. Held |
Assessing the Influence of Betaine-Based Natural Deep Eutectic Systems on Horseradish Peroxidase |
ACS Sustain. Chem. Eng. 10 (2022) 12873-12881 |
|
Research Area: III
|
|
A. F. Arroyo-Avirama, S. Ormazabal-Latorre, R. Jogi, N. F. Gajardo-Parra, C. Pazo-Carballo, M. Ascani, P. Virtanen, J. Matias Garrido, C. Held, P. Maeki-Arvela, R. I. Canales |
Improving the separation of guaiacol from n-hexane by adding choline chloride to glycol extracting agents |
J. Mol. Liq. 355 (2022) 118936 |
|
Research Area: III
|
|
A. F. Arroyo-Avirama, N. F. Gajardo-Parra, V. Espinoza-Carmona, J. Matias Garrido, C. Held, R. I. Canales |
Solvent Selection for the Extraction of 2-Phenylethanol from Aqueous Phases: Density and Viscosity Studies |
J. Chem. Eng. Data 67 (2022) 1893-1904 |
|
Research Area: III
|
|
E. Karlsson, J. Schnatwinkel, C. Paissoni, E. Andersson, C. Herrmann, C. Camilloni |
Disordered Regions Flanking the Binding Interface Modulate Affinity between CBP and NCOA |
J. Mol. Biol. 434 (2022) 167643 |
|
Research Area: I
|
|
T. Steinke, P. Wonner, R. M. Gauld, S. Heinrich, S. M. Huber |
Catalytic Activation of Imines by Chalcogen Bond Donors ina Povarov [4+2] Cycloaddition Reaction |
Chem. Eur. J. 28 (2022) e202200917 |
|
Research Area: II
|
|
N. Tarannam, M. H. H. Voelkel, S. M. Huber, S. Kozuch |
Chalcogen vs Halogen Bonding Catalysis in a Water-Bridge-Cocatalyzed Nitro-Michael Reaction |
J. Org. Chem. 87 (2022) 1661-1668 |
|
Research Area: II
|
|
J. Stoesser, E. Engelage, S. M. Huber |
Co-crystallization studies of the syn- and anti-atropisomers of triphenyl-based perfluorinated halogen bond donors with halides |
CrystEngComm 24 (2022) 6974-6979 |
|
Research Area: II
|
|
M. H. H. Voelkel, E. Engelage, M. Kondratiuk, S. M. Huber |
Evaluation of 6-halogenated 2-pyridone moieties as halogen bond donors |
Eur. J. Org. Chem. 2022 (2022) e202200211 |
|
Research Area: II
|
|
R. Papagna, D. Kutzinski, S. M. Huber |
Polymer-Bound Halogen Bonding Organocatalysis |
Eur. J. Org. Chem. 2022 (2022) e202200852 |
|
Research Area: II
|
|
J. Stoesser, E. Engelage, S. M. Huber |
Synthesizing highly fluorinated oligophenyls via Negishi coupling of fluoroarylzinc pivalates |
Synthesis 54 (2022) 711-722 |
|
Research Area: II
|
|
M. Potowski, V. B. K. Kunig, L. Eberlein, M. K. Skopic, A. Vakalopoulos, S. M. Kast |
Investigations Into Chemically Stabilized Four-Letter DNA for DNA-Encoded Chemistry |
Front. Chem. 10 (2022) 894563 |
|
Research Area: II
|
|
S. Elizarova, A. A. Chouaib, A. Shaib, B. Hill, F. Mann, N. Brose, S. Kruss, J. A. Daniel |
A fluorescent nanosensor paint detects dopamine release at axonal varicosities with high spatiotemporal resolution |
Proc. Natl. Acad. Sci. U.S.A. 119 (2022) e2202842 |
|
Research Area: II
|
|
J. Ackermann, J. T. Metternich, S. Herbertz, S. Kruss |
Biosensing with Fluorescent Carbon Nanotubes |
Angew. Chem. Int. Ed. 61 (2022) e202112372 |
|
Research Area: I
|
|
P. Clement, J. Ackermann, N. Sahin-Solmaz, S. Herbertz, G. Boero, S. Kruss, J. Brugger |
Comparison of electrical and optical transduction modes of DNA-wrapped SWCNT nanosensors for the reversible detection of neurotransmitters |
Biosens. Bioelectron. 216 (2022) 114642 |
|
Research Area: II
|
|
R. Nissler, A. T. Mueller, F. Dohrman, L. Kurth, H. Li, E. G. Cosio, B. S. Flavel, J. P. Giraldo, A. Mithoefer, S. Kruss |
Detection and Imaging of the Plant Pathogen Response by Near-Infrared Fluorescent Polyphenol Sensors |
Angew. Chem. Int. Ed. 61 (2022) e202108373 |
|
Research Area: I
|
|
G. Selvaggio, R. Nissler, P. Nietmann, A. Patra, L. J. Patalag, A. Janshoff, D. B. Werz, S. Kruss |
NIR-emitting benzene-fused oligo-BODIPYs for bioimaging |
Analyst 147 (2022) 230-237 |
|
Research Area: I
|
|
G. Selvaggio, S. Kruss |
Preparation, properties and applications of near-infrared fluorescent silicate nanosheets |
Nanoscale 14 (2022) 9553-9575 |
|
Research Area: I
|
|
R. Nissler, J. Ackermann, C. Ma, S. Kruss |
Prospects of Fluorescent Single-Chirality Carbon Nanotube-Based Biosensors |
Anal. Chem. 94 (2022) 9941-9951 |
|
Research Area: I
|
|
F. A. Mann, P. Galonska, N. Herrmann, S. Kruss |
Quantum defects as versatile anchors for carbon nanotube functionalization |
Nat. Protoc. 17 (2022) 727-747 |
|
Research Area: I
|
|
A. Klein, P. Rovo, V. V. Sakhrani, Y. Wang, J. B. Holmes, V. Liu, P. Skowronek, L. Kukuk, S. K. Vasa, P. Guentert, L. J. Mueller, R. Linser |
Atomic-resolution chemical characterization of (2x)72-kDa tryptophan synthase via four- and five-dimensional 1H-detected solid-state NMR |
Proc. Natl. Acad. Sci. U.S.A. 119 (2022) e2114690119 |
|
Research Area: I
|
|
B. C. Buchmuller, J. Droeden, H. Singh, S. Palei, M. Drescher, R. Linser, D. Summerer |
Evolved DNA Duplex Readers for Strand-Asymmetrically Modified 5-Hydroxymethylcytosine/5-Methylcytosine CpG Dyads |
J. Am. Chem. Soc. 144 (2022) 2987-2993 |
|
Research Area: II
|
|
A. Klein, S. K. Vasa, B. Soeldner, K. Grohe, R. Linser |
Unambiguous Side-Chain Assignments for Solid-State NMR Structure Elucidation of Nondeuterated Proteins via a Combined 5D/4D Side-Chain-to-Backbone Experiment |
J. Phys. Chem. Lett. 13 (2022) 1644-1651 |
|
Research Area: I
|
|
M. J. Scharf, B. List |
A Catalytic Asymmetric Pictet-Spengler Platform as a Biomimetic Diversification Strategy toward Naturally Occurring Alkaloids |
J. Am. Chem. Soc. 144 (2022) 15451-15456 |
|
Research Area: II
|
|
O. Grossmann, R. Maji, M. H. Aukland, S. Lee, B. List |
Catalytic Asymmetric Additions of Enol Silanes to In Situ Generated Cyclic, Aliphatic N-Acyliminium Ions |
Angew. Chem. Int. Ed. 61 (2022) e202115036 |
|
Research Area: II
|
|
S. Ghosh, J. E. Erchinger, R. Maji, B. List |
Catalytic Asymmetric Spirocyclizing Diels-Alder Reactions of Enones: Stereoselective Total and Formal Syntheses of alpha-Chamigrene, beta-Chamigrene, Laurencenone C, Colletoic Acid, and Omphalic Acid |
J. Am. Chem. Soc. 144 (2022) 6703-6708 |
|
Research Area: II
|
|
C. Obradors, B. Mitschke, M. Aukland, M. Leutzsch, O. Grossmann, S. Brunen, S. Schwengers, B. List |
Direct and Catalytic C-Glycosylation of Arenes: Expeditious Synthesis of the Remdesivir Nucleoside |
Angew. Chem. Int. Ed. 61 (2022) e202114619 |
|
Research Area: II
|
|
H. Zhou, J. T. Han, N. Noethling, M. M. Lindner, J. Jenniches, C. Kuehn, N. Tsuji, L. Zhang, B. List |
Organocatalytic Asymmetric Synthesis of Si-Stereogenic Silyl Ethers |
J. Am. Chem. Soc. 144 (2022) 10156-10161 |
|
Research Area: II
|
|
H. Zhou, Y. Zhou, H. Y. Bae, M. Leutzsch, Y. Li, C. K. De, G.-J. Cheng, B. List |
Organocatalytic stereoselective cyanosilylation of small ketones |
Nat. Commun. 605 (2022) 84-89 |
|
Research Area: II
|
|
R. Beckmann, F. Brieuc, C. Schran, D. Marx |
Infrared spectra at coupled cluster accuracy from neural network representations |
J. Chem. Theory Comput. 18 (2022) 5492-5501 |
|
Research Area: I
|
|
L. Duran Caballero, C. Schran, F. Brieuc, D. Marx |
Neural Network Interaction Potentials for para-Hydrogen with Flexible Molecules |
J. Chem. Phys. 7 (2022) 74302 |
|
Research Area: I
|
|
J. Noetzel, P. Schienbein, H. Forbert, D. Marx |
Solvation of Small Gold Clusters in Supercritical Water |
J. Mol. Liq. 362 (2022) 119715 |
|
Research Area: I
|
|
H. R. Larsson, M. Schroeder, R. Beckmann, F. Brieuc, C. Schran, D. Marx, O. Vendrell |
State-resolved infrared spectrum of the protonated water dimer: revisiting the characteristic proton transfer doublet peak |
Chem. Sci 13 (2022) 11119 |
|
Research Area: I
|
|
J. Daru, H. Forbert, J. Behler, D. Marx |
Coupled Cluster Molecular Dynamics of Condensed Phase Systems Enabled by Machine Learning Potentials: Liquid Water Benchmark |
Phys. Rev. Lett. 129 (2022) 226001 |
|
Research Area: I
|
|
G. Schwaab, R. Perez de Tudela, D. Mani, N. Pal, T. K. Roy, F. Gabas, R. Conte, L. Duran Caballero, M. Ceotto, D. Marx, M. Havenith |
Zwitter Ionization of Glycine at Outer Space Conditions due to Microhydration by Six Water Molecules |
Phys. Rev. Lett. 128 (2022) 33001 |
|
Research Area: III
|
|
C. Grassin, E. Santoro, C. Merten |
7-Azaindole breaks carboxylic acid dimers and simplifies VCD spectra analyses of natural products |
Chem. Commun. 58 (2022) 11527-11530 |
|
Research Area: II
|
|
L. Koser, C. Grassin, C. Merten, T. Bach |
Absolute Configuration of the Polyketide Natural Product (-)-Enterocin |
Org. Lett. 24 (2022) 6903-6907 |
|
Research Area: II
|
|
S. Shaaban, C. Merten, H. Waldmann |
Catalytic Atroposelective C7 Functionalisation of Indolines and Indoles |
Chem. Eur. J. 28 (2022) e202103365 |
|
Research Area: II
|
|
T. P. Golub, M. Fessner, E. Engelage, C. Merten |
Dynamic Stereochemistry of a Biphenyl-Bisprolineamide Model Catalyst and its Imidazolidinone Intermediates |
Chem. Eur. J. 28 (2022) e202201317 |
|
Research Area: II
|
|
M. Kemper, S. Reese, E. Engelage, C. Merten |
Inducing Propeller Chirality in Triaryl Boranes with Chiral Amines |
Chem. Eur. J. 28 (2022) e202202 |
|
Research Area: II
|
|
K. Scholten, C. Merten |
Solvation of the Boc-Val-Phe-nPr peptide characterized by VCD spectroscopy and DFT calculations |
Phys. Chem. Chem. Phys 24 (2022) 3611-3617 |
|
Research Area: II
|
|
T. P. Golub, A. H. Abazid, B. J. Nachtsheim, C. Merten |
Structure Elucidation of In Situ Generated Chiral Hypervalent Iodine Complexes via Vibrational Circular Dichroism (VCD) |
Angew. Chem. Int. Ed. 61 (2022) e202204624 |
|
Research Area: II
|
|
H. Waldmann, M. Akbarzadeh, J. Flegel, S. Patil, E. Shang, R. Narayan, M. Buchholzer, N. S. Kazemein Jasemi, M. Grigalunas, A. Krzyzanowski, D. Abegg, A. Shuster, M. Potowski, H. Karatas, G. Karageorgis, N. Mosaddeghzadeh, M.-L. Zischinsky, C. Merten, C. Golz, L. Brieger, C. Strohmann, A. P. Antonchick, P. Janning, A. Adibekian, R. S. Goody, M. Reza Ahmadian, S. Ziegler |
The Pseudo-Natural Product Rhonin Targets RHOGDI |
Angew. Chem. Int. Ed. 61 (2022) e202115193 |
|
Research Area: II
|
|
T. P. Golub , T. Kano, K. Maruoka, C. Merten |
VCD spectroscopy distinguishes the enamine and iminium ion of a 1,1'-binaphthyl azepine |
Chem. Commun. 58 (2022) 8412-8415 |
|
Research Area: II
|
|
K. Artmann, C. H. Pollok, C. Merten, P. Nuernberger |
Wavelength-dependent photochemistry of a salicylimine derivative studied with cryogenic and ultrafast spectroscopy approaches |
Phys. Chem. Chem. Phys. 24 (2022) 30017-30026 |
|
Research Area: III
|
|
M. Kemper, D. A. Drost, E. Engelage, C. Merten |
Stereochemistry Controls Dihydrogen Bonding Strengths in Chiral Amine Boranes Adducts |
Angew. Chem. Int. Ed. 61 (2022) e202213859 |
|
Research Area: II
|
|
A. Bera, K. Morgenstern |
In Situ Growth and Bias-Dependent Modification of NaBr Ionic Layers on Ag(111) |
J. Phys. Chem. C 126 (2022) 10610-10617 |
|
Research Area: III
|
|
T. Hung, D. Le, T. Rahman, K. Morgenstern |
Influence of the Moire Pattern of Ag(111)-Supported Graphitic ZnO on Water Distribution |
J. Phys. Chem. C 126 (2022) 12500-12506 |
|
Research Area: III
|
|
T. C. Hung, K. Morgenstern |
One-Dimensional Water Structures upon Cs Hydration on the Moire Pattern of Graphitic ZnO |
J. Phys. Chem. C 126 (2022) 15229-15234 |
|
Research Area: III
|
|
W. Fang, K. M. Meyer Auf der Heide, C. Zaum, A. Michaelides, K. Morgenstern |
Rapid Water Diffusion at Cryogenic Temperatures through an Inchworm-like Mechanism |
Nano Lett. 22 (2022) 340-346 |
|
Research Area: III
|
|
A. Bera, S. Henkel, J. Mieres-Perez, Y. A. Tsegaw, E. Sanchez-Garcia, W. Sander, K. Morgenstern |
Surface Diffusion Aided by a Chirality Change of Self-Assembled Oligomers under 2D Confinement |
Angew. Chem. Int. Ed. 61 (2022) e202212245 |
|
Research Area: III
|
|
Z. R. Ramadhan, A. R. Poerwoprajitno, S. Cheong, R. F. Webster, P. V. Kumar, S. Cychy, L. Gloag, T. M. Benedetti, C. E. Marjo, M. Muhler, D.-W. Wang, J. J.Gooding, W. Schuhmann, R. D. Tilley |
Introducing Stacking Faults into Three-Dimensional Branched Nickel Nanoparticles for Improved Catalytic Activity |
J. Am. Chem. Soc. 144 (2022) 11094-11098 |
|
Research Area: II
|
|
S. Bhattacharjee, M. Isegawa, M. Garcia-Rates, F. Neese, D. A. Pantazis |
Ionization Energies and Redox Potentials of Hydrated Transition Metal Ions: Evaluation of Domain-Based Local Pair Natural Orbital Coupled Cluster Approaches |
J. Chem. Theory Comput. 18 (2022) 1619-1632 |
|
Research Area: I
|
|
S.-H. Kim, S.-H. Yoo, S. Shin, A. A. El-Zoka, O. Kasian, J. Lim, J. Jeong, C. Scheu, J. Neugebauer, H. Lee, M. Todorova, B. Gault |
Controlled doping of electrocatalysts through engineering impurities |
Adv. Mater. 34 (2022) 2203030 |
|
Research Area: I
|
|
S. Kim, S.-H. Yoo, P. Chakraborty, J. Jeong, J. Lim, A. A. El-Zoka, X. Zhou, L. T. Stephenson, T. Hickel, J. Neugebauer, C. Scheu, M. Todorova, B. Gault |
Understanding Alkali Contamination in Colloidal Nanomaterials to Unlock Grain Boundary Impurity Engineering |
J. Am. Chem. Soc. 144 (2022) 987-994 |
|
Research Area: I
|
|
A. Buchmann, C. Hoberg, F. Novelli |
An ultra-fast liquid switch for terahertz radiation |
APL Photonics 7 (2022) 121302 |
|
Research Area: I
|
|
N. Suelzner, B. Geissler, A. Grandjean, G. Jung, P. Nuernberger |
Excited-State Proton Transfer Dynamics of a Super-Photoacid in Acetone-Water Mixtures |
ChemPhotoChem 6 (2022) e202200041 |
|
Research Area: I
|
|
J. Knorr, N. Suelzner, B. Geissler, C. Spies, A. Grandjean, R. J. Kutta, G. Jung, P. Nuernberger |
Ultrafast transient absorption and solvation of a super-photoacid in acetoneous environments |
Photochem. Photobiol. Sci. 21 (2022) 2179-2192 |
|
Research Area: II
|
|
G. Lipinski, K. Jeong, K. Moritz, M. Petermann, E. F. May, P. L. Stanwix, M. Richter |
Application of Raman Spectroscopy for Sorption Analysis of Functionalized Porous Materials |
Adv. Sci. 9 (2022) e2105477 |
|
Research Area: I
|
|
S. E. Sanders, A. M. Stingel, P. B. Petersen |
Wedge-Based Design for Phase Stable and Phase Accurate Heterodyne-Detected Sum-Frequency Generation Spectroscopy |
J. Phys. Chem. Lett. 13 (2022) 2072-2077 |
|
Research Area: I
|
|
S. M. Piontek, E. Borguet |
Vibrational Dynamics at Aqueous-Mineral Interfaces |
J. Phys. Chem. C 126 (2022) 2307-2324 |
|
Research Area: III
|
|
L.-M. Baumgartner, A. Erbe, A. L. Boyle, M. Rabe |
Controlling amphipathic peptide adsorption by smart switchable germanium interfaces |
Phys. Chem. Chem. Phys. 24 (2022) 4809-4819 |
|
Research Area: I
|
|
N. van Hilten, K. S. Stroh, H. J. Risselada |
Efficient quantification of lipid packing defect sensing by amphipathic peptides, comparing Martini 2 & 3 with CHARMM36 |
J. Chem. Theory Comput. 7 (2022) 4503-4514 |
|
Research Area: III
|
|
M. Ascani, G. Sadowski, C. Held |
Calculation of Multiphase Equilibria Containing Mixed Solvents and Mixed Electrolytes: General Formulation and Case Studies |
J. Chem. Eng. Data 67 (2022) 1972-1984 |
|
Research Area: III
|
|
D. Pabsch, P. Figiel, G. Sadowski, C. Held |
Solubility of Electrolytes in Organic Solvents: Solvent-Specific Effects and Ion-Specific Effects |
J. Chem. Eng. Data 67 (2022) 2706-2718 |
|
Research Area: II
|
|
D. Pabsch, J. Lindfeld, J. Schwalm, A. Strangmann, P. Figiel, G. Sadowski, C. Held |
Influence of solvent and salt on kinetics and equilibrium of esterification reactions |
Chem. Eng. Sci. 263 (2022) 118046 |
|
Research Area: II
|
|
N. Gajardo-Parra, H. O. Akrofi-Mantey, M. Ascani, E. Cea-Klapp, J. Matias Garrido, G. Sadowski, C. Held |
Osmolyte Effect on Enzymatic Stability and Reaction Equilibrium of Formate Dehydrogenase |
Phys. Chem. Chem. Phys. 24 (2022) 27930 |
|
Research Area: III
|
|
M. Ascani, D. Pabsch, M. Klinksiek, N. Gajardo-Parra, G. Sadowski, C. Held |
Prediction of pH in multiphase multicomponent systems with ePC-SAFT advanced |
Chem. Commun. 58 (2022) 8436-8439 |
|
Research Area: III
|
|
Y. B. Ruiz-Blanco , G. A. Chapin, S. R. Molina, A. Antunes, L. R. Olari, B. Spellerberg, J. Muench, E. Sanchez-Garcia |
ABP-Finder: A Tool to Identify Antibacterial Peptides and the Gram-Staining Type of Targeted Bacteria |
Antibiotics 11 (2022) 1708 |
|
Research Area: III
|
|
A. Rodriguez-Alfonso, A. Heck, Y. B. Ruiz Blanco, A. Gilg, L. Staendker, S. L. Kuan, T. Weil, E. Sanchez-Garcia, S. Wiese, J. Muench, M. Harms |
Advanced EPI-X4 derivatives covalently bind human serum albumin resulting in prolonged plasma stability |
Int. J. Mol. Sci. 23 (2022) 15029 |
|
Research Area: III
|
|
T. Weil, A. Kirupakaran, M. H. Le, P. Rebmann, J. Mieres-Perez, L. Issmail, C. Conzelmann, J. A. Mueller, L. Rauch, A. Gilg, L. Wettstein, R. Gross, C. Read, T. Bergner, S. A. Palsson, N. Uhlig, V. Eberlein, H. Woell, F. G. Klaerner, S. Stenger, B. M. Kuemmerer, H. Streeck, G. Fois, M. Frick, P. Braubach, A. L. Spetz, T. Grunwald, J. Shorter, E. Sanchez-Garcia, T. Schrader, J. Muench |
Advanced Molecular Tweezers with Lipid Anchors against SARS-CoV-2 and Other Respiratory Viruses |
J. Am. Chem. Soc. Au 2 (2022) 2187-2202 |
|
Research Area: III
|
|
J. Rey, M. Breiden, V. Lux, A. Bluemke, M. Steindel, K. Ripkens, B. Moellers, K. Bravo-Rodriguez, P. Boisguerin, R. Volkmer, J. Mieres-Perez, T. Clausen, E. Sanchez-Garcia, M. Ehrmann |
An allosteric HTRA1-calpain 2 complex with restricted activation profile |
Proc. Natl. Acad. Sci. U.S.A. 119 (2022) e2113520119 |
|
Research Area: III
|
|
M. Harms, R. F. Hansson, S. Carmali, Y. Almeida-Hernandez, E. Sanchez-Garcia, J. Muench, A. N. Zelikin |
Dimerization of the Peptide CXCR4-Antagonist on Macromolecular and Supramolecular Protraction Arms Affords Increased Potency and Enhanced Plasma Stability |
Bioconjug. Chem. 33 (2022) 594-607 |
|
Research Area: III
|
|
K. N. Ingenbosch, J. C. Vieyto-Nunez, Y. B. Ruiz-Blanco, C. Mayer, K. Hoffmann-Jacobsen, E. Sanchez-Garcia |
Effect of Organic Solvents on the Structure and Activity of a Minimal Lipase |
J. Org. Chem. 87 (2022) 1669-1678 |
|
Research Area: II
|
|
S. Romero-Molina,Y. B. Ruiz-Blanco, J. Mieres-Perez, M. Harms, J. Muench, M. Ehrmann, E. Sanchez-Garcia |
PPI-Affinity: A Web Tool for the Prediction and Optimization of Protein-Peptide and Protein-Protein Binding Affinity |
J. Proteome Res. 21 (2022) 1829-1841 |
|
Research Area: III
|
|
D. Aschmann, C. Vallet, S. K. Tripathi, Y. B. Ruiz-Blanco, M. Brabender, C. Schmuck, E. Sanchez-Garcia, S. K. Knauer, M. Giese |
Selective Disruption of Survivin's Protein-Protein Interactions: A Supramolecular Approach Based on Guanidiniocarbonylpyrrole |
ChemBioChem 23 (2022) e202100618 |
|
Research Area: II
|
|
N. Samanta, Y. B. Ruiz Blanco, Z. Fetahaj, D. Gnutt, C. Lantz, J. A. Loo, E. Sanchez-Garcia, S. Ebbinghaus |
Superoxide dismutase 1 folding stability as a target for molecular tweezers in SOD1-related amyotrophic lateral sclerosis |
ChemBioChem 23 (2022) e202200396 |
|
Research Area: II
|
|
R. Kosinski, J. Mieres Perez, E.-C. Schoeneweiss, Y. B. Ruiz-Blanco, I. Ponzo, K. Bravo-Rodriguez, M. Erkelenz, S. Schluecker, G. Uhlenbrock, E. Sanchez-Garcia, B. Sacca |
The role of DNA nanostructures in the catalytic properties of an allosterically regulated protease |
Sci. Adv. 8 (2022) eabk0425 |
|
Research Area: III
|
|
T. Schleif, W. Sander |
Photolysis and thermolysis of (iodomethyl)cyclopropane: Rapid ring opening of cyclopropylcarbinyl via heavy-atom tunneling? |
J. Phys. Org. Chem. 35 (2022) e4295 |
|
Research Area: III
|
|
A. Somani, W. Sander |
Reaction of electrons trapped in cryogenic matrices with benzophenone |
J. Phys. Org. Chem. 35 (2022) e4335 |
|
Research Area: III
|
|
T. Schleif, M. Prado. Merini, S. Henkel, W. Sander |
Solvation Effects on Quantum Tunneling Reactions |
Acc. Chem. Res. 55 (2022) 2180-2190 |
|
Research Area: III
|
|
W. Yao, Y. Wang, S. Tomilov, M. Hoffmann, S. Ahmed, C. Liebald, D. Rytz, M. Peltz, V. Wesemann, C. Saraceno |
8.7-W average power, in-band pumped femtosecond Ho: CALGO laser at 2.1 micro meter |
Opt. Express 30 (2022) 41075-41083 |
|
Research Area: I
|
|
T. Vogel, A. Omar, S. Mansourzadeh, F. Wulf, N. Martin Sabanes, M. Mueller, T. S. Seifert, A. Weigel, G. Jakob, M. Klaeui, I. Pupeza, T. Kampfrath, C. J. Saraceno |
Average power scaling of THz spintronic emitters efficiently cooled in reflection geometry |
Opt. Express 30 (2022) 20451-20468 |
|
Research Area: I
|
|
B. S. Dastrup, E. R. Sung, F. Wulf, C. Saraceno, K. A. Nelson |
Enhancement of THz generation in LiNbO3 waveguides via multi-bounce velocity matching |
Light Sci. Appl. 11 (2022) 335 |
|
Research Area: I
|
|
C. Millon, J. Schmidt, S. Ramos, E. P. van Dam, A. Buchmann, C. Saraceno, F. Novelli |
Temperature-independent non-linear terahertz transmission by liquid water |
AIP Adv. 12 (2022) 115319 |
|
Research Area: I
|
|
S. Tomilov, Y. Wang, M. Hoffmann, J.Heidrich, M. Golling, U. Keller, C. Saraceno |
50-W average power Ho: YAG SESAM-modelocked thin-disk oscillator at 2.1 micro meter |
Opt. Express 30 (2022) 27662-27673 |
|
Research Area: I
|
|
A. Alibakhshi, L. V. Schaefer |
Accurate evaluation of combustion enthalpy by ab-intio computations |
Sci. Rep. 12 (2022) 5834 |
|
Research Area: I
|
|
F. Hoffmann, F. A. A. Mulder, L. V. Schaefer |
How Much Entropy Is Contained in NMR Relaxation Parameters? |
J. Phys. Chem. B 126 (2022) 54-68 |
|
Research Area: I
|
|
S. Wingbermuehle, L. V. Schaefer |
Partial peptide dissociation and binding groove plasticity in two major histocompatibility complex class I alleles ? differences between alleles versus force field and sampling effects |
RSC Adv. 12 (2022) 29908-29914 |
|
Research Area: I
|
|
A. Dhamija, C. K. Das, Y. H. Ko, Y. Kim, R. D. Mukhopadhyay , A. Gunnam, X. Yu, I.-C. Hwang, L. V.Schaefer, K. Kim |
Remotely controllable supramolecular rotor mounted inside a porphyrinic cage |
Chem 8 (2022) 543-556 |
|
Research Area: III
|
|
S. Mukherjee, L. V. Schaefer |
Spatially Resolved Hydration Thermodynamics in Biomolecular Systems |
J. Phys. Chem. B 126 (2022) 3619-3631 |
|
Research Area: I
|
|
L. Galazzo, G. Meier, D. Januliene, K. Parey, D. De Vecchis, B. Striednig, H. Hilbi, L.V. Schaefer, I. Kuprov, A. Moeller, E. Bordignon, M. A. Seeger |
The ABC transporter MsbA adopts the wide inward-open conformation in E. coli cells |
Sci. Adv. 8 (2022) eabn6845 |
|
Research Area: I
|
|
A. A. A. I. Ali, F. Hoffmann, L. V. Schaefer, F. A. A. Mulder |
Probing Methyl Group Dynamics in Proteins by NMR Cross-Correlated Dipolar Relaxation and Molecular Dynamics Simulations |
J. Chem. Theory Comput. 18 (2022) 7722-7732 |
|
Research Area: I
|
|
T. Schleif |
Transformations of Strained Three-Membered Rings a Common, Yet Overlooked, Motif in Heavy-Atom Tunneling Reactions |
Chem. Eur. J. 28 (2022) e202201775 |
|
Research Area: III
|
|
A. R. Poerwoprajitno, L. Gloag, J. Watt, S. Cheong, X. Tan, H. Lei, H. A. Tahini, A. Henson, B. Subhash, N. M. Bedford, B. K. Miller, P. B. O?Mara, T. M. Benedetti, D. L. Huber, W. Zhang, S. C. Smith, J. J. Gooding, W. Schuhmann, R. D. Tilley |
A single-Pt-atom-on-Ru-nanoparticle electrocatalyst for CO-resilient methanol oxidation |
Nat. Catal. 5 (2022) 231-237 |
|
Research Area: I
|
|
C. S. Santos, A. Botz, A. S. Bandarenka, E. Ventosa, W. Schuhmann |
Correlative Electrochemical Microscopy for the Elucidation of the Local Ionic and Electronic Properties of the Solid Electrolyte Interphase in Li-ion Batteries |
Angew. Chem. Int. Ed. 61 (2022) e202202744 |
|
Research Area: I
|
|
X. Wang, C. Tomon, T. Bobrowski, P. Wilde, J. R. C. Junqueira, T. Quast, W. He, N. Sikdar, J. Weidner, W. Schuhmann |
Gaining the Freedom of Scalable Gas Diffusion Electrodes for the CO2 Reduction Reaction |
ChemElectroChem 9 (2022) e202200675 |
|
Research Area: II
|
|
J. Zhang, T. Quast, W. He, S. Dieckhoefer, J. R. C. Junqueira, D. Oehl, P. Wilde, D. Jambrec, Y.-T. Chen, W. Schuhmann |
In-situ Carbon Corrosion and Cu Leaching as a Strategy for Boosting Oxygen Evolution Reaction in multi-metal Electrocatalysts |
Adv. Mater. 34 (2022) 2109108 |
|
Research Area: II
|
|
W. He, J. Zhang, S. Dieckhoefer, S. Varhade, A. C. Brix, A. Lielpetere, S. Seisel, J. R. C. Junqueira, W. Schuhmann |
Splicing the active phases of copper/cobalt-based catalysts achieves high-rate tandem electroreduction of nitrate to ammonia |
Nat. Commun. 13 (2022) 1129 |
|
Research Area: II
|
|
J. Wordsworth, T. M. Benedetti, S.l V. Somerville, W. Schuhmann, R. D. Tilley, J. J. Gooding |
The Influence of Nanoconfinement on Electrocatalysis |
Angew. Chem. Int. Ed. 61 (2022) e202200755 |
|
Research Area: I
|
|
L. Banko, O. A. Krysiak, J. K. Pedersen, B. Xiao, A. Savan, T. Loeffler, S. Baha, J. Rossmeisl, W. Schuhmann, A. Ludwig |
Unravelling Composition-Activity-Stability Trends in High Entropy Alloy Electrocatalysts by Using a Data-Guided Combinatorial Synthesis Strategy and Computational Modeling |
Adv. Energy Mater. 12 (2022) 2103312 |
|
Research Area: I
|
|
T. Auth, C. J. Stein, R. A. J. O'Hair, K. Koszinowski |
Origin of the different reactivity of the high-valent coinage-metal complexes [RCuIIIMe3]- and [RAgIIIMe3]- (R=allyl) |
Chem. Eur. J. 28 (2022) e202103130 |
|
Research Area: II
|
|
D. Lesnicki, V. Wank, J. D. Cyran, E. H. G. Backus, M. Sulpizi |
Lower degree of dissociation of pyruvic acid at water surfaces than in bulk |
Phys. Chem. Chem. Phys. 24 (2022) 13510-13513 |
|
Research Area: I
|
|
D. Atarod, F. Mamashli, A. Ghasemi, F. M. Movahedi, M. Pirhaghi, H. Nedaei, V. Muronetz, T. Haertle, J. Tatzelt, G. Riazi, A. A. Saboury |
Bivalent metal ions induce formation of alpha-synuclein fibril polymorphs with different cytotoxicities |
Sci. Rep. 12 (2022) 11898 |
|
Research Area: I
|
|
G. Surmeier, S. Dogan-Surmeier, M. Paulus, C. Albers, J. Latarius, C. Sternemann, E. Schneider, M. Tolan, J. Nase |
The interaction of viral fusion peptides with lipid membranes |
Biophys. J. 121 (2022) 3811-3825 |
|
Research Area: III
|
|
J. C. Sikes, K. Wonner, A. Nicholson, P. Cignoni, I. Fritsch, K. Tschulik |
Characterization of Nanoparticles in Diverse Mixtures Using Localized Surface Plasmon Resonance and Nanoparticle Tracking by Dark-Field Microscopy with Redox Magnetohydrodynamics Microfluidics |
ACS Phys. Chem. Au 2 (2022) 289-298 |
|
Research Area: I
|
|
M. Corva, N. Blanc, C. J. Bondue, K. Tschulik |
Differential Tafel Analysis: A Quick and Robust Tool to Inspect and Benchmark Charge Transfer in Electrocatalysis |
ACS Catal. 12 (2022) 13805-13812 |
|
Research Area: I
|
|
C. Rurainsky , D.R. Nettler , T. Pahl, A. Just, P. Cignoni , K. Kanokkanchana, K.Tschulik |
Electrochemical Dealloying in a Magnetic Field - Tapping the Potential for Catalyst and Material Design Potential for Catalyst and Material Design |
Electrochim. Acta 426 (2022) 140807 |
|
Research Area: II
|
|
M. Jaugstetter, N. Blanc, M. Kratz, K. Tschulik |
Electrochemistry under confinement |
Chem. Soc. Rev. 51 (2022) 2491-2543 |
|
Research Area: III
|
|
K. Kanokkanchana, K. Tschulik |
Electronic Circuit Simulations as a Tool to Understand Distorted Signals in Single-Entity Electrochemistry |
J. Phys. Chem. Lett. 13 (2022) 10120-10125 |
|
Research Area: I
|
|
M. Azimzadeh Sani, N. G. Pavlopoulos, S. Pezzotti, A. Serva, P. Cignoni, J. Linnemann, M. Salanne, M.-P. Gaigeot, K. Tschulik |
Unexpectedly High Capacitance of the Metal Nanoparticle/Water Interface - Molecular Level Insights into the Electrical Double Layer |
Angew. Chem. Int. Ed. 61 (2022) e202112679 |
|
Research Area: I
|
|
J. C. Sikes, I. I. Niyonshuti, K. Kanokkanchana, J. Chen, K.Tschulik, I. Fritsch |
Single Particle Electrochemical Oxidation of Polyvinylpyrrolidone-Capped Silver Nanospheres, Nanocubes, and Nanoplates in Potassium Nitrate and Potassium Hydroxide Solutions |
J. Electrochem. Soc. 169 (2022) 56508 |
|
Research Area: I
|
|
E. N. Saw, K. Kanokkanchana, H. M. A. Amin, K. Tschulik |
Unravelling Anion Solvation in Water-Alcohol Mixtures by Single Entity Electrochemistry |
ChemElectroChem 9 (2022) e202101435 |
|
Research Area: I
|
|
R. Aymerich-Armengol, P. Cignoni, P. Ebbinghaus, J. Linnemann, M. Rabe, K. Tschulik, C. Scheu, J. Lim |
Mechanism of coupled phase/morphology transformation of 2D manganese oxides through Fe galvanic exchange reaction |
J. Mater. Chem. A 10 (2022) 24190-24198 |
|
Research Area: I
|
|
M. L. Meister, Y. Brueggemann, M. K. Nocke, R. G. Ulrich, J. Schuhenn, K. Sutter, A. Goemer, V. Bader, K. F. Winklhofer, R. Broering, L. Verhoye, P. Meuleman, F. W. R. Vondran, C. Camuzet, L. Cocquerel, D. Todt , E. Steinmann |
A ribavirin-induced ORF2 single-nucleotide variant produces defective hepatitis E virus particles with immune decoy function |
Proc. Natl. Acad. Sci. U.S.A. 119 (2022) e2202653119 |
|
Research Area: I
|
|
C. M. Buehl, J. Reinhard, L. Roll, V. Bader, K. F.Winklhofer, A. Faissner |
Brevican, Neurocan, Tenascin-C and Tenascin-R Act as Important Regulators of the Interplay between Perineuronal Nets, Synaptic Integrity, Inhibitory Interneurons and Otx2 |
Front. Cell Dev. Biol. 10 (2022) 886527 |
|
Research Area: I
|
|
M. Junghans, F. John, H. Cihankaya, D. Schliebs, K. Winklhofer, V. Bader, J. Matschke, C. Theiss, V. Matschke |
ROS scavengers decrease gamma-H2ax spots in motor neuronal nuclei of ALS model mice in vitro |
Front. Cell. Neurosci. 16 (2022) 963169 |
|
Research Area: I
|
|
L. J. Krause, M. G. Herrera, K. F. Winklhofer |
The Role of Ubiquitin in Regulating Stress Granule Dynamics |
Front. Physiol. 13 (2022) 910759 |
|
Research Area: I
|
|
Z. Wu, L. A. Berlemann, V. Bader, D. A. Sehr, E. Dawin, A. Covallero, J. Meschede, L. Angersbach, C. Showkat, J. B. Michaelis, C. Muench, B. Rieger, D. Namgaladze, M. G.Herrera, F.C Fiesel, W. Springer, M. Mendes, J. Stepien, K. Barkovits, K. Marcus, A. Sickman, G. Dittmar, K.B. Busch, D.Riedel, M. Brini, J. Tatzelt, T. Cali, K.F. Winklhofer |
LUBAC assembles a ubiquitin signaling platform at mitochondria for signal amplification and transport of NF-kappaB to the nucleus |
EMBO J. 41 (2022) e112006 |
|
Research Area: I
|
|
L. Misuraca, A. Calio, J. G. LoRicco, I. Hoffmann, R. Winter, B. Deme, J. Peters, P. M. Oger |
Alkanes as Membrane Regulators of the Response of Early Membranes to Extreme Temperatures |
Life 12 (2022) 445 |
|
Research Area: III
|
|
R. Oliva, S. Mukherjee, M. Manisegaran, M. Campanile, P. D. Vecchio, L. Petraccone, R. Winter |
Binding Properties of RNA Quadruplex of SARS-CoV-2 to Berberine Compared to Telomeric DNA Quadruplex |
Int. J. Mol. Sci. 23 (2022) 5690 |
|
Research Area: III
|
|
A. Kamali, N. J. Azizi, R. Oliva, R. Winter |
Deep sea osmolytes in action: their effect on protein-ligand binding under high pressure stress |
Phys. Chem. Chem. Phys. 24 (2022) 17966-17978 |
|
Research Area: III
|
|
H. Cinar, R. Oliva, H. Wu, M. Zhang, H. S. Chan, R. Winter |
Effects of Cosolvents and Crowding Agents on the Stability and Phase Transition Kinetics of the SynGAP/PSD-95 Condensate Model of Postsynaptic Densities |
J. Phys. Chem. B 126 (2022) 1734-1741 |
|
Research Area: III
|
|
M. Moron, A. A. Masoodi, C. Lovato, M. Reiser, L. Randolph, G. Surmeier, J. Bolle, F. Westermeier, M. Sprung, R. Winter, M. Paulus, C. Gutt |
Gelation Dynamics upon Pressure-Induced Liquid-Liquid Phase Separation in a Water?Lysozyme Solution |
J. Phys. Chem. B 126 (2022) 4160-4167 |
|
Research Area: III
|
|
R. Oliva, R. Winter |
Harnessing Pressure-Axis Experiments to Explore Volume Fluctuations, Conformational Substates, and Solvation of Biomolecular Systems |
J. Phys. Chem. Lett. 13 (2022) 12099-12115 |
|
Research Area: III
|
|
B. Harish, J. Wang, E. J. Hayden, B. Grabe, W. Hiller, R. Winter |
Hidden intermediates in Mango III RNA aptamer folding revealed by pressure perturbation |
Biophys. J. 121 (2022) 421-429 |
|
Research Area: III
|
|
S. K. Mukherjee, J.-M. Knop, R. Winter |
High-Pressure Single-Molecule Studies on Non-Canonical Nucleic Acids and Their Interactions |
Handbook of Chemical Biology of Nucleic Acids (2022) 34 pages |
|
Research Area: III
|
|
S. K. Mukherjee, J.-M. Knop, R. Winter |
Modulation of the Conformational Space of SARS-CoV-2 RNA Quadruplex RG-1 by Cellular Components and the Amyloidogenic Peptides ?-Synuclein and hIAPP |
Chem. Eur. J. 28 (2022) e202104182 |
|
Research Area: III
|
|
J.-M. Knop, S. K. Mukherjee, S. Gault, C. S. Cockell, R. Winter |
Structural Responses of Nucleic Acids to Mars-Relevant Salts at Deep Subsurface Conditions |
Life 12 (2022) 677 |
|
Research Area: III
|
|
Z. Fetahaj, M. W. Jaworek, R. Oliva, R. Winter |
Suppression of Liquid-Liquid Phase Separation and Aggregation of Antibodies by Modest Pressure Application |
Chem. Eur. J. 28 (2022) e202201658 |
|
Research Area: III
|
|
R. Oliva, M. Campanile, P. Del Vecchio, E. Pizzo, A. Bosso, R. Winter, L. Petraccone |
The C-terminus of the GKY20 antimicrobial peptide, derived from human thrombin, plays a key role in its membrane-perturbation capability |
Phys. Chem. Chem. Phys. 24 (2022) 7994-8002 |
|
Research Area: III
|
|
J. T. Kleinhaus, F. Wittkamp, S. Yadav, D. Siegmund, U.-P. Apfel |
[FeFe]-Hydrogenases: maturation and reactivity of enzymatic systems and overview of biomimetic models |
Chem. Soc. Rev. 50 (2021) 1668-1784 |
|
Research Area: II
|
|
J. Deutscher, P. Gerschel, K. Warm, U. Kuhlmann, S. Mebs, M. Haumann, H. Dau, P. Hildebrandt, U.-P. Apfel, K. Ray |
A bioinspired oxoiron(iv) motif supported on a N2S2 macrocyclic ligand |
Chem. Commun. 57 (2021) 2947-2950 |
|
Research Area: II
|
|
J. Joekel, F. Nyssen, D. Siegmund, U.-P. Apfel |
An asymmetric cryptand for the site-specific coordination of 3d metals in multiple oxidation states |
Dalton Trans. 50 (2021) 14602-14610 |
|
Research Area: II
|
|
B. Lv, X. Li, K. Guo, J. Ma, Y. Wang, H. Lei, F. Wang, X. Jin, Q. Zhang, W. Zhang, R. Long, Y. Xiong, U.-P. Apfel, R. Cao |
Controlling Oxygen Reduction Selectivity through Steric Effects: Electrocatalytic Two-Electron and Four-Electron Oxygen Reduction with Cobalt Porphyrin Atropisomers |
Angew. Chem. Int. Ed. 60 (2021) 12742-12746 |
|
Research Area: I
|
|
D. Siegmund, S. Metz, V. Peinecke, T. E. Warner, C. Cremers, A. Greve, T. Smolinka, D. Segets, U.-P. Apfel |
Crossing the Valley of Death: From Fundamental to Applied Research in Electrolysis |
J. Am. Chem. Soc. Au 1 (2021) 527-535 |
|
Research Area: I
|
|
L. Xie, X.-P. Zhang , B. Zhao, P. Li, J. Qi, X. Guo, B. Wang, H. Lei, W. Zhang, U.-P. Apfel, R. Cao |
Enzyme-Inspired Iron Porphyrins for Improved Electrocatalytic Oxygen Reduction and Evolution Reactions |
Angew. Chem. Int. Ed. 60 (2021) 7576-7581 |
|
Research Area: II
|
|
D. Tetzlaff, K. Pellumbi, K. junge Puring, D. Siegmund, W. S. K. Polet, M. P. Checinski, U.-P. Apfel |
Influence of the Fe:Ni ratio in FexNi9-xS8 (x= 3-6) on the CO2 electroreduction |
ChemElectroChem 8 (2021) 3161-3167 |
|
Research Area: II
|
|
P. Gerschel, A. L. Cordes, S. Bimmermann, D. Siegmund, N. Metzler-Nolte, U.-P. Apfel |
Investigation of Cyclam Based Re-Complexes as Potential Electrocatalysts for the CO2 Reduction Reaction |
Z. Anorg. Allg. Chem. 647 (2021) 968-977 |
|
Research Area: II
|
|
C. Simon, M. Barakat Zakaria, H. Kurz, D. Tetzlaff, A. Bloesser, M. Weiss, J. Timm, B. Weber, U.-P. Apfel, R. Marschall |
Magnetic NiFe2O4 nanoparticles prepared via non-aqueous microwave-assisted synthesis for application in electrocatalytic water oxidation |
Chem. Eur. J 27 (2021) 16990-17001 |
|
Research Area: I
|
|
C. Simon, J. Timm, D. Tetzlaff, J. Jungmann, U.-P. Apfel, R. Marschall |
Mesoporous NiFe2O4 with tuneable pore morphology for electrocatalytic water oxidation |
ChemElectroChem 8 (2021) 227-239 |
|
Research Area: I
|
|
Z. Liang, H. Guo, G. Zhou, K. Guo, B. Wang, H. Lei, W. Zhang, H. Zheng, U.-P. Apfel |
Metal-Organic Framework-Supported Molecular Electrocatalysis for the Oxygen Reduction Reaction |
Angew. Chem. Int. Ed. 60 (2021) 8472-8476 |
|
Research Area: I
|
|
M. B. Z. Hegazy, M. R. Berber, Y. Yamauchi, A. Pakdel, R. Cao, U.-P. Apfel |
Synergistic Electrocatalytic Hydrogen Evolution in Ni/NiS Nanoparticles Wrapped in Multi-Heteroatom-Doped Reduced Graphene Oxide Nanosheets |
ACS Appl. Mater. Interfaces 13 (2021) 34043-34052 |
|
Research Area: I
|
|
H. M. A. Amin, M. Attia, D. Tetzlaff, U.-P. Apfel |
Tailoring the Electrocatalytic Activity of Pentlandite FexNi9-XS8 Nanoparticles via Variation of the Fe:Ni Ratio for Enhanced Water Oxidation |
ChemElectroChem 8 (2021) 3863-3874 |
|
Research Area: I
|
|
M. H. G. Prechtl, U.-P. Apfel |
Toward electrocatalytic chemoenzymatic hydrogen evolution and beyond |
Cell Rep. Phys. Sci. 2 (2021) 100626 |
|
Research Area: II
|
|
M. Winkler, J. Duan, A. Rutz, C. Felbeck, L. Scholtysek, O. Lampret, J. Jaenecke, U.-P. Apfel, G. Gilardi, F. Valetti, V. Fourmond, E. Hofmann, C. Leger, T. Happe |
A safety cap protects hydrogenase from oxygen attack |
Nat. Commun. 12 (2021) 756 |
|
Research Area: II
|
|
T. E. Assafa, S. Nandi, D. Smilowicz, L. Galazzo, M. Teucher, C. Elsner, S. Puetz, S. Bleicken, A. Y. Robin, D. Westphal, I. Uson, R. Stoll, P. E. Czabotar, N. Metzler-Nolte, E. Bordignon |
Biophysical characterization of pro-apoptotic BimBH3 peptides reveals an unexpected capacity for self-association |
Structure 29 (2021) 114-124.E3 |
|
Research Area: I
|
|
S. Kucher, C. Elsner, M. Safonova, S. Maffini, E. Bordignon |
In-Cell Double Electron-Electron Resonance at Nanomolar Protein Concentrations |
J. Phys. Chem. Lett. 12 (2021) 3679-3684 |
|
Research Area: I
|
|
B. Sharma, V.-A. Tran, T. Pongratz, L. Galazzo, I. Zhurko, E. Bordignon, S. M. Kast, F. Neese, D. Marx |
A Joint Venture of Ab Initio Molecular Dynamics, Coupled Cluster Electronic Structure Methods, and Liquid-State Theory to Compute Accurate Isotropic Hyperfine Constants of Nitroxide Probes in Water |
J. Chem. Theory Comput. 17 (2021) 6366-6386 |
|
Research Area: I
|
|
G. Zwaschka, F. Lapointe, R. K. Campen, Y. Tong |
Characterization of Ultrafast Processes at Metal/Solution Interfaces: Towards Femtoelectrochemistry |
Curr. Opin. Electrochem. 29 (2021) 100813 |
|
Research Area: I
|
|
K. Wu, B. Zhang, C. Drechsler, J. J. Holstein, G. H. Clever |
Backbone-Bridging Promotes Diversity in Heteroleptic Cages |
Angew. Chem. Int. Ed. 60 (2021) 6403-6407 |
|
Research Area: II
|
|
I. Regeni, B. Chen, M. Frank, A. Baksi, J. J. Holstein, G. H. Clever |
Coal-Tar Dye-based Coordination Cages and Helicates |
Angew. Chem. Int. Ed. 60 (2021) 5673-5678 |
|
Research Area: II
|
|
P. M. Punt, M. D. Langenberg, O. Altan, G. H. Clever |
Modular Design of G-Quadruplex Metallo DNAzymes for Catalytic C-C Bond Formations with Switchable Enantioselectivity |
J. Am. Chem. Soc. 143 (2021) 3555-3561 |
|
Research Area: II
|
|
S. Horiuchi, S. Moon, A. Ito, J. Tessarolo, E. Sakuda, Y. Arikawa, G. H. Clever, K. Umakoshi |
Multinuclear Ag Clusters Sandwiched by Pt Complex Units: Fluxional Behavior and Chiral-at-Cluster Photoluminescence |
Angew. Chem. Int. Ed. 60 (2021) 10654-10660 |
|
Research Area: II
|
|
A. Ivanova, A. Chesnokov, D. Bocharov, K. S. Exner |
A Universal Approach to Quantify Overpotential-Dependent Selectivity Trends for the Competing Oxygen Evolution and Peroxide Formation Reactions: A Case Study on Graphene Model Electrodes |
J. Phys. Chem. C 125 (2021) 10413-10421 |
|
Research Area: I
|
|
K. S. Exner |
Boosting the Stability of RuO2 in the Acidic Oxygen Evolution Reaction by Tuning Oxygen-Vacancy Formation Energies: A Viable Approach Beyond Noble-Metal Catalysts? |
ChemElectroChem 8 (2021) 46-48 |
|
Research Area: I
|
|
T. Lim, J. H. Kim, J. Kim, D. S. Baek, T. J. Shin, H. Y. Jeong, K.-S. Lee, K. S. Exner, S. H. Joo |
General Efficacy of Atomically Dispersed Pt Catalysts for the Chlorine Evolution Reaction: Potential-Dependent Switching of the Kinetics and Mechanism |
ACS Catal. 11 (2021) 12232-12246 |
|
Research Area: I
|
|
K. S. Exner, A. Ivanova |
Method to Construct Volcano Relations by Multiscale Modeling: Building Bridges between the Catalysis and Biosimulation Communities |
J. Phys. Chem. B 125 (2021) 2098-2104 |
|
Research Area: II
|
|
K. S. Exner |
On the Lattice Oxygen Evolution Mechanism: Avoiding Pitfalls |
ChemCatChem 13 (2021) 4066-4074 |
|
Research Area: I
|
|
K. S. Exner |
The Electrochemical-Step Asymmetry Index |
MethodsX 8 (2021) 101590 |
|
Research Area: I
|
|
H. Ooka, J. Huang, K. S. Exner |
The Sabatier Principle in Electrocatalysis: Basics, Limitations, and Extensions |
Front. Energy Res. 9 (2021) 654460 |
|
Research Area: I
|
|
K. S. Exner |
Why approximating electrocatalytic activity by a single free-energy change is insufficient |
Electrochim. Acta 375 (2021) 137975 |
|
Research Area: I
|
|
K. S. Exner |
Why the breaking of the OOH vs. OH scaling relation may cause decreased electrocatalytic activity |
Chem. Catal. 1 (2021) 258-271 |
|
Research Area: I
|
|
K. S. Exner |
Why the Optimum Thermodynamic Free-Energy Landscape of the Oxygen Evolution Reaction Reveals an Asymmetric Shape |
Mater. Today Energy 21 (2021) 100831 |
|
Research Area: I
|
|
H. Darmandeh, J. Loeffler, N. V. Tzouras, B. Dereli, T. Scherpf, K.-S. Feichtner, S. Vanden Broeck, K. van Hecke, M. Saab, C. S. J. Cazin, L. Cavallo, S. P. Nolan, V. H. Gessner |
Au...H-C Hydrogen Bonds as Design Principle in Gold(I) Catalysis |
Angew. Chem. Int. Ed. 60 (2021) 21014-21024 |
|
Research Area: II
|
|
H. Steinert, J. Loeffler, V. H. Gessner |
Single-Site and Cooperative Bond Activation Reactions with Ylide-Functionalized Tetrylenes: A Computational Study |
Eur. J. Inorg. Chem. 2021 (2021) 5004-5013 |
|
Research Area: II
|
|
J. Handelmann, C. N. Babu, H. Steinert, C. Schwarz, T. Scherpf, A. Krolla, V. H. Gessner |
Towards the rational design of ylide-substituted phosphines for gold(I)-catalysis: from inactive to ppm-level catalysis |
Chem. Sci. 12 (2021) 4329-4337 |
|
Research Area: II
|
|
J. Loeffler, R. M. Gauld, K.-S. Feichtner, I. Rodstein, J.-A. Zur, J. Handelmann, C. Schwarz, V. H. Gessner |
Ylide-Substituted Phosphines with a Cyclic Ylide-Backbone: Angle Dependence of the Donor Strength |
Organometallics 40 (2021) 2888-2900 |
|
Research Area: II
|
|
Z. Hu, X.-J. Wie, J. Handelmann, A.-K. Seitz, I. Rodstein, V. H. Gessner, L. J. Goossen |
Coupling of Reformatsky Reagents with Aryl Chlorides Enabled by Ylide-Functionalized Phosphine Ligands |
Angew. Chem. Int. Ed. 60 (2021) 6778-6783 |
|
Research Area: II
|
|
K. Dilchert, M. Schmidt, A. Grossjohann, K.-S. Feichtner, R. E. Mulvey, V. H. Gessner |
Solvation Effects on the Structure and Stability of Alkali Metal Carbenoids |
Angew. Chem. Int. Ed. 60 (2021) 493-498 |
|
Research Area: II
|
|
Z. Zeng, J. F. Goebel, X. Liu, L. J. Goossen |
2,2'-Biaryldicarboxylate Synthesis via Electrocatalytic Dehydrogenative C-H/C-H Coupling of Benzoic Acids |
ACS Catal. 11 (2021) 6626-6632 |
|
Research Area: II
|
|
Z. Zeng, A. Feceu, N. Sivendran, L. J. Goossen |
Decarboxylation-Initiated Intermolecular Carbon-Heteroatom Bond Formation |
Adv. Synth. Catal. 363 (2021) 2678-2722 |
|
Research Area: II
|
|
E. Feresin, M. Kondratiuk, J. Nowack, L. J. Goossen |
Destroying the Coronavirus in a simple Way Hand cleaning at the molecular Level-The Role of Solvation |
Chemie Unserer Zeit 55 (2021) 28-37 |
|
Research Area: II
|
|
M. Oseka, G. Laudadio, N. P. van Leest, M. Dyga, A. de A. Bartolomeu, L. J. Goossen, B. de Bruin, K. T. de Oliveira, T. Noel |
Electrochemical Aziridination of Internal Alkenes with Primary Amines |
Chem 7 (2021) 255-266 |
|
Research Area: II
|
|
N. Sivendran, N. Pirkl, Z. Hu, A. Doppiu, L. J. Goossen |
Halogen-Bridged Methylnaphthyl Palladium Dimers as Versatile Catalyst Precursors in Coupling Reactions |
Angew. Chem. Int. Ed. 60 (2021) 25151-25160 |
|
Research Area: II
|
|
D. Koley, S. De, N. Sivendran, L. J. Goossen |
Isomerization of Functionalized Olefins by Using the Dinuclear Catalyst [Pd-I(mu-Br)((PBu3)-Bu-t)](2): A Mechanistic Study |
Chem. Eur. J. 27 (2021) 15227-15239 |
|
Research Area: II
|
|
Z. Hu, F. Belitz, G. Zhang, F. Papp, L. J. Goossen |
Ru-Catalyzed (E)-Specific ortho-C-H Alkenylation of Arenecarboxylic Acids by Coupling with Alkenyl Bromides |
Org. Lett. 23 (2021) 3541-3545 |
|
Research Area: II
|
|
K. Laun, I. Baranova, J. Duan, L. Kertess, F. Wittkamp, U.-P. Apfel, T. Happe, M. Senger, S. T. Stripp |
Site-selective protonation of the one-electron reduced cofactor in [FeFe]-hydrogenase |
Dalton Trans. 50 (2021) 3641-3650 |
|
Research Area: II
|
|
M. Heghmanns, A. Guenzel, D. Brandis, Y. Kutin, V. Engelbrecht, M. Winkler, T. Happe, M. Kasanmascheff |
Fine-tuning of FeS proteins monitored via pulsed EPR redox potentiometry at Q-band |
Biophys. Rep. 1 (2021) 100016 |
|
Research Area: I
|
|
S. Tsuru, B. Sharma, M. Nagasaka, C. Haettig |
Solvent Effects in the Ultraviolet and X-ray Absorption Spectra of Pyridazine in Aqueous Solution |
J. Phys. Chem. A 125 (2021) 7198-7206 |
|
Research Area: I
|
|
S. Karbalaei Khani, B. Geissler, E. Engelage, P. Nuernberger, C. Haettig |
Tracing absorption and emission characteristics of halogen-bonded ion pairs involving halogenated imidazolium species |
Phys. Chem. Chem. Phys. 23 (2021) 7480-7494 |
|
Research Area: II
|
|
C. Y. Ma , S. Pezzotti , G. Schwaab , M. Gebala , D. Herschlag, M. Havenith |
Cation enrichment in the ion atmosphere is promoted by local hydration of DNA |
Phys. Chem. Chem. Phys. 23 (2021) 23203-23213 |
|
Research Area: I
|
|
T. K. Roy, K. Chatterjee, J. Khatri, G. Schwaab, M. Havenith |
Helium nanodroplet infrared spectroscopy of oxazole-(water)n (n = 1,2) clusters |
AIP Adv. 11 (2021) 115112 |
|
Research Area: III
|
|
T. K. Roy , D. Mani , G. Schwaab, M. Havenith |
Infrared Spectroscopic Study of Trifluoromethoxybenzene-Methanol Complexes Formed in Superfluid Helium Nanodroplets |
Phys. Chem. Chem. Phys. 23 (2021) 25180-25187 |
|
Research Area: III
|
|
S. Pezzotti, A. Serva, F. Sebastiani, F. Siro Brigiano, D. R. Galimberti, L. Potier, S. Alfarano, G. Schwaab, M. Havenith, M.-P. Gaigeot |
Molecular Fingerprints of Hydrophobicity at Aqueous Interfaces from Theory and Vibrational Spectroscopies |
J. Phys. Chem. Lett. 12 (2021) 3827-3836 |
|
Research Area: I
|
|
A. Serva, M. Salanne, M. Havenith, S. Pezzotti |
Size dependence of hydrophobic hydration at electrified gold/water interfaces |
Proc. Natl. Acad. Sci. U.S.A. 118 (2021) e2023867118 |
|
Research Area: I
|
|
T. K. Roy, K.Chatterjee, J. Khatri, G. Schwaab, M. Havenith |
Stepwise Microhydration of Isoxazole: Infrared Spectroscopy of Isoxazole-(Water)n<=2 Clusters in Helium Nanodroplets |
J. Phys. Chem. A 125 (2021) 4766-4774 |
|
Research Area: III
|
|
J. Khatri, T. K. Roy, K. Chatterjee, G. Schwaab, M. Havenith |
Vibrational Spectroscopy of Benzonitrile-(Water)1-2 Clusters in Helium Droplets |
J. Phys. Chem. A 125 (2021) 6954-6963 |
|
Research Area: III
|
|
E. M. Adams, S. Pezzotti, J. Ahlers, M. Ruettermann, M. Levin, A. Goldenzweig, Y. Peleg, S. J. Fleishman, I. Sagi, M. Havenith |
Local Mutations Can Serve as a Game Changer for Global Protein Solvent Interaction |
J. Am. Chem. Soc. Au 1 (2021) 1076-1085 |
|
Research Area: I
|
|
E. M. Adams, H. Hao, I. Leven, M. Ruettermann, H. Wirtz, M. Havenith, T. Head-Gordon |
Proton Traffic Jam: Effect of Nanoconfinement and Acid Concentration on Proton Hopping Mechanism |
Angew. Chem. Int. Ed. 60 (2021) 25419-25427 |
|
Research Area: III
|
|
C. Loy, J. M. Holthoff, R. Weiss, S. M. Huber, S. V. Rosokha |
"Anti-electrostatic" halogen bonding in solution |
Chem. Sci. 12 (2021) 8246-8251 |
|
Research Area: II
|
|
F. Heinen, D. L. Reinhard, E. Engelage, S. M. Huber |
A Bidentate Iodine(III)-Based Halogen-Bond Donor as a Powerful Organocatalyst |
Angew. Chem. Int. Ed. 60 (2021) 5069-5073 |
|
Research Area: II
|
|
T. Steinke, P. Wonner, E. Engelage, S. M. Huber |
Catalytic Activation of a Carbon-Chloride Bond by Dicationic Tellurium-Based Chalcogen Bond Donors |
Synthesis 53 (2021) 2043-2050 |
|
Research Area: II
|
|
E. Engelage, H. Hijazi, M. Gartmann, L.-M. Chamoreau, B. Schollhorn, S. M. Huber, C. Fave |
Towards redox-switchable organocatalysts based on bidentate halogen bond donors |
Phys. Chem. Chem. Phys 23 (2021) 4344-4352 |
|
Research Area: II
|
|
D. L. Reinhard, F. Heinen, J. Stoesser, E. Engelage, S. M. Huber |
Tuning the Halogen Bonding Strength of Cyclic Diaryliodonium Salts |
Helv. Chim. Acta 104 (2021) e2000221 |
|
Research Area: II
|
|
M. Joerges, A. Kroll, L. Kelling, R. Gauld, B. Mallick, S. M. Huber, V. H. Gessner |
Synthesis, Crystal and Electronic Structures of a Thiophosphinoyl- and Amino-Substituted Metallated Ylide |
ChemistryOpen 10 (2021) 1089-1094 |
|
Research Area: II
|
|
S. Hasegawa, S. L. Meichsner, J. J. Holstein, A. Baksi, M. Kasanmascheff, G. H. Clever |
Long-Lived C60 Radical Anion Stabilized Inside an Electron-Deficient Coordination Cage |
J. Am. Chem. Soc. 143 (2021) 9718-9723 |
|
Research Area: III
|
|
Y. Kutin, J. Reitz, P. W. Antoni, A. Savitsky, D. A. Pantazis, M. Kasanmascheff, M. M. Hansmann |
Characterization of a Triplet Vinylidene |
J. Am. Chem. Soc. 143 (2021) 21410-21415 |
|
Research Area: II
|
|
S. L. Meichsner, Y. Kutin, M. Kasanmascheff |
In-Cell Characterization of the Stable Tyrosyl Radical in E. coli Ribonucleotide Reductase Using Advanced EPR Spectroscopy |
Angew. Chem. Int. Ed. 60 (2021) 19155-19161 |
|
Research Area: I
|
|
L. M. Stratmann, Y. Kutin, M. Kasanmascheff, G. H. Clever |
Precise Distance Measurements in DNA G-Quadruplex Dimers and Sandwich Complexes by Pulsed Dipolar EPR Spectroscopy |
Angew. Chem. Int. Ed. 60 (2021) 4939-4947 |
|
Research Area: I
|
|
M. Potowski, V. B. K. Kunig, L. Eberlein, A. Vakalopoulos, S. M. Kast, A. Brunschweiger |
Chemically Stabilized DNA Barcodes for DNA-Encoded Chemistry |
Angew. Chem. Int. Ed. 60 (2021) 19744-19749 |
|
Research Area: I
|
|
T. D. Bergazin, N. Tielker, Y. Zhang, J. Mao, M. R. Gunner, K. Francisco, C. Ballatore, S. M. Kast, D. L. Mobley |
Evaluation of log P, pKa, and log D predictions from the SAMPL7 blind challenge |
J. Comput. Aided Mol. Des. 35 (2021) 771-802 |
|
Research Area: I
|
|
N. Tielker, L. Eberlein, G. Hessler, K. F. Schmidt, S. Guessregen, S. M. Kast |
Quantum-mechanical property prediction of solvated drug molecules: what have we learned from a decade of SAMPL blind prediction challenges? |
J. Comput. Aided Mol. Des. 35 (2021) 453-475 |
|
Research Area: I
|
|
N. Tielker, S. Guessregen, S. M. Kast |
SAMPL7 physical property prediction from EC-RISM theory |
J. Comput. Aided Mol. Des. 35 (2021) 933-941 |
|
Research Area: I
|
|
G. Selvaggio, M. Weitzel, N. Oleksiievets, T. A. Oswald, R. Nissler, I. Mey, V. Karius, J. Enderlein, R. Tsukanov, S. Kruss |
Photophysical properties and fluorescence lifetime imaging of exfoliated near-infrared fluorescent silicate nanosheets |
Nanoscale Adv. 3 (2021) 4541-4553 |
|
Research Area: II
|
|
A. Spreinat, M. M. Dohmen, J. Luettgens, N. Herrmann, L. F. Klepzig, R. Nissler, S. Weber, F. A. Mann, J. Lauth, S. Kruss |
Quantum defects in fluorescent carbon nanotubes for sensing and mechanistic studies |
J. Phys. Chem. C 125 (2021) 18341-18351 |
|
Research Area: I
|
|
R. Nissler, L. Kurth, H. Li, A. Spreinat, I. Kuhlemann, B. S. Flavel, S. Kruss |
Sensing with Chirality Pure near Infrared Fluorescent Carbon Nanotubes |
Anal. Chem. 93 (2021) 6446-6455 |
|
Research Area: II
|
|
R. Pallach, J. Keupp, K. Terlinden, L. Frentzel-Beyme, M. Kloss, A. Machalica, J. Kotschy, S. K. Vasa, P. A. Chater, C. Sternemann, M. T. Wharmby, R. Linser, R. Schmid, S. Henke |
Frustrated flexibility in metal-organic frameworks |
Nat. Commun. 12 (2021) 4097 |
|
Research Area: II
|
|
C. Obradors, B. List |
Azine Activation via Silylium Catalysis |
J. Am. Chem. Soc. 143 (2021) 6817-6822 |
|
Research Area: II
|
|
C. Zhu, F. Mandrelli, H. Zhou, R. Maji, B. List |
Catalytic Asymmetric Synthesis of Unprotected beta 2-Amino Acids |
J. Am. Chem. Soc. 143 (2021) 3312-3317 |
|
Research Area: II
|
|
T. Amatov, N. Tsuji, R. Maji, L. Schreyer, H. Zhou, M. Leutzsch, B. List |
Confinement-Controlled, Either syn- or anti-Selective Catalytic Asymmetric Mukaiyama Aldolizations of Propionaldehyde Enolsilanes |
J. Am. Chem. Soc. 143 (2021) 14475-14481 |
|
Research Area: III
|
|
P. Zhang, N. Tsuji, J. Ouyang, B. List |
Strong and Confined Acids Catalyze Asymmetric Intramolecular Hydroarylations of Unactivated Olefins with Indoles |
J. Am. Chem. Soc. 143 (2021) 675-680 |
|
Research Area: II
|
|
C. D. Diaz-Oviedo, R. Maji, B. List |
The Catalytic Asymmetric Intermolecular Prins Reaction |
J. Am. Chem. Soc. 143 (2021) 20598-20604 |
|
Research Area: II
|
|
H. Zhou, P. Zhang, B. List |
The Silicon-Hydrogen Exchange Reaction: Catalytic Kinetic Resolution of 2-Substituted Cyclic Ketones |
Synlett 32 (2021) 1953-1956 |
|
Research Area: II
|
|
D. Munoz-Santiburcio, D. Marx |
Confinement-Controlled Aqueous Chemistry within Nanometric Slit Pores Focus Review |
Chem. Rev. 121 (2021) 6293-6320 |
|
Research Area: III
|
|
C. Hoelzl, H. Forbert, D. Marx |
Dielectric relaxation of water: assessing the impact of localized modes, translational diffusion, and collective dynamics |
Phys. Chem. Chem. Phys. 23 (2021) 20875-20882 |
|
Research Area: I
|
|
C. Schran, F. Brieuc, D. Marx |
Transferability of machine learning potentials: Protonated water neural network potential applied to the protonated water hexamer |
J. Chem. Phys. 154 (2021) 51101 |
|
Research Area: I
|
|
R. Tripathi, L. Duran Caballero, R. Perez de Tudela, C. Hoelzl, D. Marx |
Unveiling Zwitterionization of Glycine in the Microhydration Limit |
ACS Omega 6 (2021) 12676-12683 |
|
Research Area: III
|
|
J. Thomas, C. Bertram, J. Daru, J. Patwari, I. Langguth, P. Zhou, D. Marx, K. Morgenstern, U. Bovensiepen |
Competition between Coulomb and van der Waals Interactions in Xe-Cs+ Aggregates on Cu(111) Surfaces |
Phys. Rev. Lett. 127 (2021) 266802 |
|
Research Area: I
|
|
I. Kolling, C. Hoelzl, S. Imoto, S. R. Alfarano, H. Vondracek, L. Knake, F. Sebastiani, F. Novelli, C. Hoberg, J.-B. Brubach, P. Roy, H. Forbert, G. Schwaab, D. Marx, M. Havenith |
Aqueous TMAO solution under high hydrostatic pressure |
Phys. Chem. Chem. Phys. 23 (2021) 11355-11365 |
|
Research Area: III
|
|
F. Sebastiani, C. Y. Ma, S. Funke, A. Baeumer, D. Decka, C. Hoberg, A. Esser, H. Fobert, G. Schwaab, D. Marx, M. Havenith |
Probing Local Electrostatics of Glycine in Aqueous Solution by THz Spectroscopy |
Angew. Chem. Int. Ed. 60 (2021) 3768-3772 |
|
Research Area: I
|
|
M. Kemper, E. Engelage, C. Merten |
Chiral Molecular Propellers of Triarylborane Ammonia Adducts |
Angew. Chem. Int. Ed. 60 (2021) 2958-2962 |
|
Research Area: II
|
|
S. R. Domingos, C. Perez, N. M. Kreienborg, C. Merten, M. Schnell |
Dynamic chiral self-recognition in aromatic dimers of styrene oxide revealed by rotational spectroscopy |
Commun. Chem. 4 (2021) 32 |
|
Research Area: II
|
|
F. Burg, C. Buchelt, N. M. Kreienborg, C. Merten, T. Bach |
Enantioselective Synthesis of Diaryl Sulfoxides Enabled by Molecular Recognition |
Org. Lett. 23 (2021) 1829-1834 |
|
Research Area: II
|
|
D. P. Demarque, M. Kemper, C. Merten |
VCD spectroscopy reveals that a water molecule determines the conformation of azithromycin in solution dagger |
Chem. Commun. 57 (2021) 4031-4034 |
|
Research Area: I
|
|
T. P. Golub, C. Merten |
Vibrational CD study on the solution phase structures of the MacMillan catalyst and its corresponding iminium ion |
Phys. Chem. Chem. Phys. 23 (2021) 25162-25169 |
|
Research Area: II
|
|
P. Srivastava, D. P. Miller, K. Morgenstern |
Influence of the Lattice Structure of Copper Surfaces on Ammonia Dimer Formation |
J. Phys. Chem. C 125 (2021) 24363-24370 |
|
Research Area: I
|
|
K. Lucht, K. Morgenstern |
Polymorphic arrangement of an organic molecule in its hydration environment |
J. Chem. Phys. 154 (2021) 14701 |
|
Research Area: II
|
|
M. Vyshnepolsky, Z.-B. Ding, P. Srivastava, P. Tesarik, H. Mazhar, M. Maestri, K. Morgenstern |
The Influence of a Changing Local Environment during Photoinduced CO2 Dissociation |
Angew. Chem. Int. Ed. 60 (2021) 18217-18222 |
|
Research Area: I
|
|
T. Falk, S. Anke, H. Hajiyani, S. Saddeler, S. Schulz, R. Pentcheva, B. Peng, M. Muhler |
Influence of the particle size on selective 2-propanol gas-phase oxidation over Co3O4 nanospheres |
Catal. Sci. Technol. 11 (2021) 7552-7562 |
|
Research Area: I
|
|
N. Sikdar, P. Schwiderowski, D. Medina, S. Dieckhoefer, T. Quast, A. C. Brix, S. Cychy, M. Muhler, J. Masa, W. Schuhmann |
Trace metal loading of B and N co-doped graphitic carbon for active and stable bifunctional oxygen reduction and oxygen evolution electrocatalysts |
ChemElectroChem 8 (2021) 1685-1693 |
|
Research Area: I
|
|
A. Sirohiwal, F. Neese, D. A. Pantazis |
Chlorophyll excitation energies and structural stability of the CP47 antenna of photosystem II: a case study in the first-principles simulation of light-harvesting complexes |
Chem. Sci. 12 (2021) 4463-4476 |
|
Research Area: I
|
|
A. Sirohiwal, F. Neese, D. A. Pantazis |
How Can We Predict Accurate Electrochromic Shifts for Biochromophores? A Case Study on the Photosynthetic Reaction Center |
J. Chem. Theory Comput. 17 (2021) 1858-1873 |
|
Research Area: I
|
|
M. Garcia-Rates, U. Becker, F. Neese |
Implicit solvation in domain based pair natural orbital coupled cluster (DLPNO-CCSD) theory |
J. Comput. Chem. 42 (2021) 1959-1973 |
|
Research Area: I
|
|
S. Surendralal, M. Todorova, J. Neugebauer |
Impact of Water Coadsorption on the Electrode Potential of H-Pt(1 1 1)-Liquid Water Interfaces |
Phys. Rev. Lett. 126 (2021) 166802 |
|
Research Area: I
|
|
F. Deissenbeck, C. Freysoldt, M. Todorova, J. Neugebauer, S. Wippermann |
Dielectric Properties of Nanoconfined Water: A Canonical Thermopotentiostat Approach |
Phys. Rev. Lett. 126 (2021) 136803 |
|
Research Area: III
|
|
S.-H. Yoo, M. Todorova, D. Wickramaratne, L. Weston, C. G. Van de Walle, J. Neugebauer |
Finite-size correction for slab supercell calculations of materials with spontaneous polarization |
NPJ Comput. Mater. 7 (2021) 58 |
|
Research Area: I
|
|
A. M. Stingel, P. B. Petersen |
Full spectrum 2D IR spectroscopy reveals below-gap absorption and phonon dynamics in the mid-IR bandgap semiconductor InAs |
J. Chem. Phys. 155 (2021) 104202 |
|
Research Area: I
|
|
S. Hardt, S. Stapf, D. T. Filmon, J. A. Birrell, O. Ruediger, V. Fourmond, C. Leger, N. Plumere |
Reversible H2 oxidation and evolution by hydrogenase embedded in a redox polymer film |
Nat. Catal. 4 (2021) 251-258 |
|
Research Area: II
|
|
H. Li, G. Kopiec, F. Mueller, F. Nyssen, M. Ceccato, K. Daasbjerg, N. Plumere |
Spectroscopic Evidence for a Covalent Sigma Au-C Bond on Au Surfaces Using 13C Isotope Labeling |
J. Am. Chem. Soc. Au 1 (2021) 362-368 |
|
Research Area: I
|
|
X. Zhong, M. Schulz, C.-H. Wu, M. Rabe, A. Erbe, M. Rohwerder |
Limiting Current Density of Oxygen Reduction under Ultrathin Electrolyte Layers: From the Micrometer Range to Monolayers |
ChemElectroChem 8 (2021) 712-718 |
|
Research Area: I
|
|
N. F. Gajardo-Parra, H. T. Do, M. Yang, J. R. Perez-Correa, J. M. Garrido, G. Sadowski, C. Held, R. I. Canales |
Impact of deep eutectic solvents and their constituents on the aqueous solubility of phloroglucinol dihydrate |
J. Mol. Liq. 344 (2021) 117932 |
|
Research Area: III
|
|
K. Wysoczanska, B. Nierhauve, G. Sadowski, E. A. Macedo, C. Held |
Solubility of DNP-amino acids and their partitioning in biodegradable ATPS: Experimental and ePC-SAFT modeling |
Fluid Phase Equilib. 527 (2021) 1112830 |
|
Research Area: I
|
|
M. W. Jaworek, N. F. Gajardo-Parra, G. Sadowski, R. Winter, C. Held |
Boosting the Kinetic Efficiency of Formate Dehydrogenase by Combining the Effects of Temperature, High Pressure and Co-solvent Mixtures |
Colloids Surf. B. 208 (2021) 112127 |
|
Research Area: III
|
|
L. Wettstein, T. Weil, C. Conzelmann, J. A. Mueller, R. Gro?, M. Hirschenberger, A. Seidel, S. Klute, F. Zech, C. P. Bozzo, N. Preising, G. Fois, R. Lochbaum, P. M. Knaff, V. Mailaender, L. Staendker, D. R. Thal, C. Schumann, S. Stenger, A. Kleger, G. Lochnit, B. Mayer, Y. B. Ruiz-Blanco, M. Hoffmann, K. M. J. Sparrer, S. Poehlmann, E. Sanchez-Garcia, F. Kirchhoff, M. Frick, J. Muench |
Alpha-1 antitrypsin inhibits TMPRSS2 protease activity and SARS-CoV-2 infection |
Nat. Commun. 12 (2021) 1726 |
|
Research Area: II
|
|
M. Boehm, K. Killinger, A. Dudziak, P. Pant, K. Jaenen, S. Hohoff, K. Mechtler, M. Oerd, M. Loog, E. Sanchez-Garcia, S. Westermann |
Cdc4 phospho-degrons allow differential regulation of Ame1CENP-U protein stability across the cell cycle |
eLife 10 (2021) e67390 |
|
Research Area: I
|
|
P. Sokkar, M. Harms, C. Stuerzel, A. Gilg, G. Kizilsavas, M. Raasholm, N. Preising, M. Wagner, F. Kirchhoff, L. Staendker, G. Weidinger, B. Mayer, J. Muench, E. Sanchez-Garcia |
Computational modeling and experimental validation of the EPI-X4/CXCR4 complex allows rational design of small peptide antagonists |
Commun. Biol. 4 (2021) 1113 |
|
Research Area: II
|
|
R. Malishev, N. Salinas, J. Gibson, A. Bailey Eden, J. Mieres-Perez, Y. B. Ruiz-Blanco, O. Malka, S. Kolusheva, F.-G. Klaerner, T. Schrader, E. Sanchez-Garcia, C. Wang, M. Landau, G. Bitan, R. Jelinek |
Inhibition of Staphylococcus aureus biofilm-forming functional amyloid by molecular tweezers |
Cell Chem. Biol. 28 (2021) 1310-1320 |
|
Research Area: II
|
|
A. Meiners, S. Baecker, C. Heid, C. Beuck, Y. B. Ruiz-Blanco, J. Mieres-Perez, M. Poerschke, J.-N. Grad, C. Vallet, D. Hoffmann, P. Bayer, E. Sanchez-Garcia, T. Schrader, S. K. Knauer, I. Hadroyic |
Specific inhibition of the Survivin-CRM1 interaction by peptide-modified molecular tweezers |
Nat. Commun. 12 (2021) 1505 |
|
Research Area: II
|
|
T. Lohmiller, S. K. Sarkar, J. Tatchen, S. Henkel, T. Schleif, A. Savitsky, E. Sanchez-Garcia, W. Sander |
Sequential Hydrogen Tunneling in o-Tolylmethylene |
Chem. Eur. J. 27 (2021) 17873-17879 |
|
Research Area: III
|
|
G. Koenig, P. Sokkar, N. Pryk, S. Heinrich, D. Moeller, G. Cimicata, D. Matzov, P. Dietze, W. Thiel, A. Bashan, J. E. Bandow, J. Zuegg, A. Yonath, F. Schulz, E. Sanchez-Garcia |
Rational prioritization strategy allows the design of macrolide derivatives that overcome antibiotic resistance |
Proc. Natl. Acad. Sci. U.S.A. 118 (2021) e2113632118 |
|
Research Area: II
|
|
A. Gutierrez-Quintanilla, Y. Layssac, T. Butscher, S. Henkel, Y. A. Tsegaw, D. Grote, W. Sander, F. Borget, T. Chiavassa, F. Duvernay |
iCOM formation from radical chemistry: a mechanistic study from cryogenic matrix coupled with IR and EPR spectroscopies |
Mon. Notices Royal Astron. Soc. 506 (2021) 3734-3750 |
|
Research Area: III
|
|
S. Henkel, M. P. Merini, E. Mendez-Vega, W. Sander |
Lewis acid catalyzed heavy atom tunneling - the case of 1H-bicyclo[3.1.0]-hexa-3,5-dien-2-one |
Chem. Sci. 12 (2021) 11013-11019 |
|
Research Area: III
|
|
A. C. Plenert, E. Mendez-Vega, W. Sander |
Micro- vs Macrosolvation in Reichardt's Dyes |
J. Am. Chem. Soc. 143 (2021) 13156-13166 |
|
Research Area: I
|
|
S. V. Chapyshev, E. Mendez-Vega, W. Sander |
Molecular Magnets: The Synthesis and Characterization of High-Spin Nitrenes |
Chem. Eur. J. 27 (2021) 1258-1269 |
|
Research Area: II
|
|
J. Mieres-Perez, K. Lucht, I. Trosien, W. Sander, E. Sanchez-Garcia, K. Morgenstern |
Controlling Reactivity - Real-Space Imaging of a Surface Metal Carbene |
J. Am. Chem. Soc. 143 (2021) 4653-4660 |
|
Research Area: II
|
|
F. Wulf, M. Hoffmann, C. J. Saraceno |
Analysis of THz generation using the tilted-pulse-front geometry in the limit of small pulse energies and beam sizes |
Opt. Express 29 (2021) 18889-18904 |
|
Research Area: I
|
|
S. Mansourzadeh, D. Damyanov, T. Vogel, F. Wulf, R. B. Kohlhaas, B. Globisch, T. Schultze, M. Hoffmann, J. C. Balzer, C. J. Saraceno |
High-Power Lensless THz Imaging of Hidden Objects |
IEEE Access 9 (2021) 6268-6276 |
|
Research Area: I
|
|
S. Mansourzadeh, T. Vogel, M. Shalaby, F. Wulf, C. J. Saraceno |
Milliwatt average power, MHz-repetition rate, broadband THz generation in organic crystal BNA with diamond substrate |
Opt. Express 29 (2021) 38946-38957 |
|
Research Area: I
|
|
S. Tomilov, M. Hoffmann, Y. Wang, C. J. Saraceno |
Moving towards high-power thin-disk lasers in the 2 micro meter wavelength range |
J. Phys. Photonics 3 (2021) 022002 |
|
Research Area: I
|
|
C. Paeslack, C. K. Das, J. Schlitter, L. V. Schaefer |
Spectrally Resolved Estimation of Water Entropy in the Active Site of Human Carbonic Anhydrase II |
J. Chem. Theory Comput. 17 (2021) 5409-5418 |
|
Research Area: I
|
|
M. Osorio-Valeriano, F. Altegoer, C. K. Das, W. Steinchen, G. Panis, L. Connolley, G. Giacomelli, H. Feddersen, L. Corrales-Guerrero, P. I. Giammarinaro, J. Hanssmann, M. Bramkamp, P. H. Viollier, S. Murray, L. V. Schaefer, G. Bange, M. Thanbichler |
The CTPase activity of ParB determines the size and dynamics of prokaryotic DNA partition complexes |
Mol. Cell 81 (2021) 3992-4001 |
|
Research Area: I
|
|
S. M. Gopal, S. Wingbermuehle, J. Schnatwinkel, S. Juber, C. Herrmann, L. V. Schaefer |
Conformational Preferences of an Intrinsically Disordered Protein Domain: A Case Study for Modern Force Fields |
J. Phys. Chem. B 125 (2021) 24-35 |
|
Research Area: I
|
|
C. Paeslack, L. V. Schaefer, M. Heyden |
Protein flexibility reduces solvent-mediated friction barriers of ligand binding to a hydrophobic surface patch |
Phys. Chem. Chem. Phys. 23 (2021) 5665-5672 |
|
Research Area: I
|
|
S. Kozuch, T. Schleif, A. Karton |
Quantum mechanical tunnelling: the missing term to achieve sub-kJ mol barrier heights |
Phys. Chem. Chem. Phys. 23 (2021) 10888-10898 |
|
Research Area: III
|
|
N. Sikdar, J. R. C. Junqueira, S. Dieckhoefer, T. Quast, M. Braun, Y. Song, H. B. Aiyappa, S. Seisel, J. Weidner, D.Oehl, C. Andronescu, W. Schuhmann |
A metal-organic framework derived CuxOyCz catalyst for electrochemical CO2 reduction and impact of local pH change |
Angew. Chem. Int. Ed. 60 (2021) 23427-23434 |
|
Research Area: II
|
|
M. Riedel, S. Hofs, A. Ruff, W. Schuhmann, F. Lisdat |
A Tandem Solar Biofuel Cell: Harnessing Energy from Light and Biofuels |
Angew. Chem. Int. Ed. 60 (2021) 2078-2083 |
|
Research Area: III
|
|
J. K. Pedersen, C. M. Clausen, O. A. Krysiak, B. Xiao, T. A. A. Batchelor, T. Loeffler, V. A. Mints, L. Banko, M. Arenz, A. Savan, W. Schuhmann, A. Ludwig, J. Rossmeisl |
Bayesian Optimization of High-Entropy Alloy Compositions for Electrocatalytic Oxygen Reduction |
Angew. Chem. Int. Ed. 60 (2021) 24144-24152 |
|
Research Area: I
|
|
Y. Song, J. R. C. Junqueira, N. Sikdar, D. Oehl, S. Dieckhoefer, T. Quast, S. Seisel, J. Masa, C. Andronescu, W. Schuhmann |
B-Cu-Zn Gas Diffusion Electrodes for CO2 Electroreduction to C2+-Products at High Current Densities |
Angew. Chem. Int. Ed. 60 (2021) 9135-9141 |
|
Research Area: II
|
|
P. Wang, A. Frank, F. Zhao, J. Szczesny, J. R. Junqueira, S. Zacarias, A. Ruff, M. M. Nowaczyk, I. A. C. Pereira, M. Roegner, F. Conzuelo, W. Schuhmann |
Closing the Gap for Electronic Short-Circuiting: Photosystem I Mixed Monolayers Enable Improved Anisotropic Electron Flow in Biophotovoltaic Devices |
Angew. Chem. Int. Ed. 60 (2021) 2000-2006 |
|
Research Area: II
|
|
T. A. A. Batchelor, T. Loeffler, B. Xiao, O. A. Krysiak, V. Strotkoetter, J. K. Pedersen, C. M. Clausen, A. Savan, Y. Li, W. Schuhmann, J. Rossmeisl, A. Ludwig |
Complex-Solid-Solution Electrocatalyst Discovery by Computational Prediction and High-Throughput Experimentation |
Angew. Chem. Int. Ed. 60 (2021) 6932-6937 |
|
Research Area: I
|
|
P. Wilde, P. B. O'Mara, J. R. C. Junqueira, T. Tarnev, T. M. Benedetti , C. Andronescu, Y.-T. Chen, R. D. Tilley, W. Schuhmann, J. J. Gooding |
Is Cu instability during the CO2 reduction reaction governed by the applied potential or the local CO concentration? |
Chem. Sci. 12 (2021) 4028-4033 |
|
Research Area: II
|
|
S. Dieckhofer, D. Oehl, J. C. R. Junqueira, T. Quast, T. Turek, W. Schuhmann |
Probing the Local Reaction Environment During High Turnover Carbon Dioxide Reduction with Ag-Based Gas Diffusion Electrodes |
Chem. Eur. J. 27 (2021) 5906-5912 |
|
Research Area: II
|
|
P. Wang, F. Zhao, A. Frank, S. Zerria, A. Lielpetere, A. Ruff, M. M. Nowaczyk, W. Schuhmann, F. Conzuelo |
Rational Design of a Photosystem I Photoanode for the Fabrication of Biophotovoltaic Devices |
Adv. Energy Mater. 11 (2021) 2102858 |
|
Research Area: II
|
|
T. Quast, S. Varhade, S. Saddeler, Y.-T. Chen, C. Andronescu, S. Schulz, W. Schuhmann |
Single Particle Nanoelectrochemistry Reveals the Catalytic Oxygen Evolution Reaction Activity of Co3O4 Nanocubes |
Angew. Chem. Int. Ed. 60 (2021) 23444-23450 |
|
Research Area: I
|
|
T. Quast, H. B. Aiyappa, S. Saddeler, P. Wilde, Y.-T. Chen, S. Schulz, W. Schuhmann |
Single-Entity Electrocatalysis of Individual "Picked-and-Dropped" Co3O4 Nanoparticles on the Tip of a Carbon Nanoelectrode |
Angew. Chem. Int. Ed. 60 (2021) 3576-3580 |
|
Research Area: I
|
|
T. Loeffler, A. Ludwig, J. Rossmeisl, W. Schuhmann |
What makes high-entropy alloys exceptional electrocatalysts? |
Angew. Chem. Int. Ed. 60 (2021) 26894-26903 |
|
Research Area: I
|
|
S. Cychy, S. Lechler, Z. Huang, M. Braun, A. C. Brix, P. Bluemler, C. Andronescu, F. Schmid, W. Schuhmann, M. Muhler |
Optimizing the nickel boride layer thickness in a spectroelectrochemical ATR-FTIR thin-film flow cell applied in glycerol oxidation |
Chinese J. Catal. 42 (2021) 2206-2215 |
|
Research Area: I
|
|
S. A. Polido, J. Kamps, J. Tatzelt |
Biological functions of the intrinsically disordered N-terminal domain of the prion protein, a possible role of liquid-liquid phase separation |
Biomolecules 11 (2021) 1201 |
|
Research Area: III
|
|
L. Linsenmeier, B. Mohammadi, M. Shafiq, K. Frontzek, J. Baer, A. N. Shrivastava, M. Damme, F. Song, A. Schwarz, S. Da Vela, T. Massignan, S. Jung, A. Correia, M. Schmitz, B. Puig, S. Hornemann, I. Zerr, J. Tatzelt, E. Biasini, P. Saftig, M. Schweizer, D. Svergun, L. Amin, F. Mazzola, L. Varani, S. Thapa, S. Gilch, H. Schaetzl, D. A. Harris, A. Triller, M. Mikhaylova, A. Aguzzi, H. C. Altmeppen, M. Glatzel |
Ligands binding to the prion protein induce its proteolytic release with therapeutic potential in neurodegenerative proteinopathies |
Sci. Adv. 7 (2021) eabj1826 |
|
Research Area: III
|
|
S. B. Sangeetham, A. D. Engelke, E. Fodor, S. L. Krausz, J. Tatzelt, E. Welker |
The G127V variant of the prion protein interferes with dimer formation in vitro but not in cellulo |
Sci. Rep. 11 (2021) 3116 |
|
Research Area: I
|
|
R. Oliva, S. K. Mukherjee, L. Ostermeier, L. A. Pazurek, S. Kriegler, V. Bader, D. Prumbaum, S. Raunser, K. F. Winklhofer, J. Tatzelt, R. Winter |
Remodeling of the Fibrillation Pathway of alpha-Synuclein by Interaction with Antimicrobial Peptide LL-III |
Chem. Eur. J. 27 (2021) 11845-11851 |
|
Research Area: I
|
|
J. Linnemann, K. Kanokkanchana, K. Tschulik |
Design Strategies for Electrocatalysts from an Electrochemist's Perspective |
ACS Catal. 11 (2021) 5318-5346 |
|
Research Area: I
|
|
A. BalaKrishnan, N. Blanc, U. Hagemann, P. Gemagami, K. Wonner, K. Tschulik, T. Li |
Direct Detection of Surface Species Formed on Iridium Electrocatalysts during the Oxygen Evolution Reaction |
Angew. Chem. Int. Ed. 60 (2021) 21396-21403 |
|
Research Area: I
|
|
K. Tschulik |
Physical and nano electrochemistry 2021 rising stars at the horizon of nanoscale electrochemistry |
Curr. Opin. Electrochem. 29 (2021) 100815 |
|
Research Area: I
|
|
S. R. Alfarano, S. Pezzotti, C. J. Stein, Z. Lin, F. Sebastiani, S. Funke, C. Hoberg, I. Kolling, C. Yu Ma, K. Mauelshagen, T. Ockelmann, G. Schwaab, L. Fu, J.-B. Brubach, P. Roy, M. Head-Gordon, K. Tschulik, M.-P. Gaigeot, M. Havenith |
Stripping away ion hydration shells in electrical double-layer formation: Water networks matter |
Proc. Natl. Acad. Sci. U.S.A. 118 (2021) e2108568118 |
|
Research Area: I
|
|
S. Najafishirtari, K. F. Ortega, M. Douthwaite, S. Pattisson, G. J. Hutchings, C. J. Bondue, K. Tschulik, D. Waffel, B. Peng, M. Deitermann, G. W. Busser, M. Muhler, M. Behrens |
A Perspective on Heterogeneous Catalysts for the Selective Oxidation of Alcohols |
Chem. Eur. J. 27 (2021) 16809-16833 |
|
Research Area: II
|
|
H. Geraili Daronkola, A. Vila Verde |
Proteins maintain hydration at high [KCl] concentration regardless of content in acidic amino acids |
Biophys. J. 120 (2021) 2746-2765 |
|
Research Area: I
|
|
J. R. Robalo, D. Mendes de Oliveira, D. Ben-Amotz, A. Vila Verde |
Influence of Methylene Fluorination and Chain Length on the Hydration Shell Structure and Thermodynamics of Linear Diols |
J. Phys. Chem. B 125 (2021) 13552-13564 |
|
Research Area: I
|
|
A. Ulfig, V. Bader, M. Varatnitskaya, N. Lupilov, K. F. Winklhofer, L. I. Leichert |
Hypochlorous acid-modified human serum albumin suppresses MHC class II - dependent antigen presentation in pro-inflammatory macrophages |
Redox Biol. 43 (2021) 101981 |
|
Research Area: I
|
|
L. Lei, Z. Wu, K. F. Winklhofer |
Protein quality control by the proteasome and autophagy: A regulatory role of ubiquitin and liquid-liquid phase separation |
Matrix Biol. 100-101 (2021) 9-22 |
|
Research Area: III
|
|
J. Ahlers, E. M. Adams, V. Bader, S. Pezzotti, K. F. Winklhofer, J. Tatzelt, M. Havenith |
The key role of solvent in condensation: mapping water in liquid-liquid phase-separated |
Biophys. J. 120 (2021) 1266-1275 |
|
Research Area: III
|
|
Z. Fetahaj, L. Ostermeier, H. Cinar, R. Oliva, R. Winter |
Biomolecular Condensates under Extreme Martian Salt Conditions |
J. Am. Chem. Soc. 143 (2021) 5247-5259 |
|
Research Area: III
|
|
S. Kriegler, T. O. Paulisch, T. Wegner, F. Glorius, R. Winter |
Bipolar Imidazolium-Based Lipid Analogues for Artificial Archaeosomes |
Langmuir 37 (2021) 11996-12006 |
|
Research Area: III
|
|
M. W. Jaworek, R. Winter |
Exploring Enzymatic Activity in Multiparameter Space: Cosolvents, Macromolecular Crowders and Pressure |
ChemSystemsChem 2 (2021) e2000029 |
|
Research Area: III
|
|
L. Ostermeier, G. A. P. de Oliveira, W. Dzwolak, J. L. Silva, R. Winter |
Exploring the polymorphism, conformational dynamics and function of amyloidogenic peptides and proteins by temperature and pressure modulation |
Biophys. Chem. 268 (2021) 106506 |
|
Research Area: III
|
|
R. Oliva, N. Jahmidi-Azizi, S. Mukherjee, R. Winter |
Harnessing Pressure Modulation for Exploring Ligand Binding Reactions in Cosolvent Solutions |
J. Phys. Chem. B 125 (2021) 539-546 |
|
Research Area: III
|
|
F. Battista, R. Oliva, P. Del Vecchio, R. Winter, L. Petraccone |
Insights into the Action Mechanism of the Antimicrobial Peptide Lasioglossin III |
Int. J. Mol. Sci. 22 (2021) 2875 |
|
Research Area: I
|
|
N. Jahmidi-Azizi, S. Gault, C. S. Cockell, R. Oliva, R. Winter |
Ions in the Deep Subsurface of Earth, Mars, and Icy Moons: Their Effects in Combination with Temperature and Pressure on tRNA-Ligand Binding |
Int. J. Mol. Sci. 22 (2021) 10861 |
|
Research Area: III
|
|
L. Li, M. Herzog, S. Moebitz, R. Winter |
Liquid droplets of protein LAF1 provide a vehicle to regulate storage of the signaling protein K-Ras4B and its transport to the lipid membrane |
Phys. Chem. Chem. Phys. 23 (2021) 5370-5375 |
|
Research Area: III
|
|
S. Gault, M. W. Jaworek, R. Winter, C. S. Cockell |
Perchlorate salts confer psychrophilic characteristics in alpha-chymotrypsin |
Sci. Rep. 11 (2021) 16523 |
|
Research Area: III
|
|
M. Herzog, L. Li, C. C. Blesken, G. Welsing, T. Tiso, L. M. Blank, R. Winter |
Phase separation of an active colloidal suspension via quorum-sensing |
Soft Matter 17 (2021) 3191-3206 |
|
Research Area: III
|
|
S. Kriegler, M. Herzog, R. Oliva, S. Gault, C. S. Cockell, R. Winter |
Structural responses of model biomembranes to Mars-relevant salts |
Phys. Chem. Chem. Phys. 23 (2021) 14212-14223 |
|
Research Area: III
|
|
N. Jahmidi-Azizi, R. Oliva, S. Gault, C. S. Cockell, R. Winter |
The Effects of Temperature and Pressure on Protein-Ligand Binding in the Presence of Mars-Relevant Salts |
Biology 10 (2021) 687 |
|
Research Area: III
|
|
M. K. Skopic, C. Gramse, R. Oliva, S. Pospich, L. Neukirch, M. Manisegaran, S. Raunser, R. Winter, R. Weberskirch, A. Brunschweiger |
Towards DNA-Encoded Micellar Chemistry: DNA-Micelle Association and Environment Sensitivity of Catalysis |
Chem. Eur. J. 27 (2021) 10048-10057 |
|
Research Area: III
|
|
R. Oliva, S. Mukherjee, R. Winter |
Unraveling the binding characteristics of small ligands to telomeric DNA by pressure modulation |
Sci. Rep. 11 (2021) 9714 |
|
Research Area: III
|
|
S. K. Mukherjee, J.-M. Knop, R. Oliva, S. Moebitz, R. Winter |
Untangling the interaction of alpha-synuclein with DNA i-motifs and hairpins by volume-sensitive single-molecule FRET spectroscopy |
RSC Chem. Biol. 2 (2021) 1196-1200 |
|
Research Area: III
|
|
J. Kamps, Y.-H. Lin, R. Oliva, V. Bader, R. Winter, K. F. Winklhofer, J. Tatzelt |
The N-terminal domain of the prion protein is required and sufficient for liquid-liquid phase separation: A crucial role of the Abeta-binding domain |
J. Biol. Chem. 297 (2021) 1000860 |
|
Research Area: III
|
|
M. Dyga, C. Oppel, L. J. Goossen |
RotoMate: An open-source, 3D printed autosampler for use with benchtop nuclear magnetic resonance spectrometers |
HardwareX 10 (2021) e00211 |
|
Research Area: II
|
|
K. Chatterjee, T. K. Roy, J. Khatri, G. Schwaab, M. Havenith |
Unravelling the microhydration frameworks of prototype PAH by infrared spectroscopy: naphthalene?(water)1?3 |
Phys. Chem. Chem. Phys 23 (2021) 14016-14026 |
|
Research Area: III
|
|
J. Joekel, F. Schwer, M. Delius, U.-P. Apfel |
A dinuclear porphyrin-macrocycle as efficient catalyst for the hydrogen evolution reaction |
Chem. Commun. 56 (2020) 14179-14182 |
|
Research Area: II
|
|
R. N. De, S. Gonglach, S. Paul, M. Haas, S. S. Sreejith, P. Gerschel, U.-P. Apfel, T.H. Vuong, J. Rabeah, S. Roy, W. Schoefberger |
Electrocatalytic Reduction of CO2 to Acetic Acid by a Molecular Manganese Corrole Complex |
Angew. Chem. Int. Ed. 59 (2020) 10527-10534 |
|
Research Area: II
|
|
L. Iffland, D. Siegmund, U.-P. Apfel |
Electrochemical CO2 and Proton Reduction by a Co(dithiacyclam) Complex |
Z. Allg. Anorg. Chem. 646 (2020) 746-753 |
|
Research Area: II
|
|
K. junge Puring, D. Siegmund, J. Timm, F. Moellenbruck, S. Schemme, R. Marschall, U.-P. Apfel |
Electrochemical CO2 Reduction: Tailoring Catalyst Layers in Gas Diffusion Electrodes |
Adv. Sustain. Syst. 5 (2020) 2000088 |
|
Research Area: II
|
|
K. Pellumbi, M. Smialkowski, D. Siegmund, U.-P. Apfel |
Enhancing the CO2 Eletroreduction of Fe/Ni-Pentlandite Catalysts by S/Se Exchange |
Chem. Eur. J 26 (2020) 9938-9944 |
|
Research Area: II
|
|
X. J. Guo, N. Wang, X. L. Li, Z. Y. Zhang, J. P. Zhao, W. J. Ren, S. P. Ding, G. L. Xu, J. F. Li, U.-P. Apfel, W. Zhang, R. Cao |
Homolytic versus Heterolytic Hydrogen Evolution Reaction Steered by a Steric Effect |
Angew. Chem. Int. Ed. 59 (2020) 8941-8946 |
|
Research Area: II
|
|
A. Al-Shameri, M.-C. Petrich, K. Junge Puring, U.-P. Apfel, B. M. Nestl, L. Lauterbach |
Powering artificial enzymatic cascades with electrical energy |
Angew. Chem. Int. Ed. 59 (2020) 10929-10933 |
|
Research Area: II
|
|
D. Tetzlaff, K. Pellumbi, D. M. Baier, L. Hoof, H. S. Barkur, M. Smialkowski, H. M. A. Amin, S. Gratz, D. Siegmund, L. Borchardt, U.-P. Apfel |
Sustainable and rapid preparation of nanosized Fe/Ni-pentlandite particles by mechanochemistry |
Chem. Sci 11 (2020) 12835-12842 |
|
Research Area: I
|
|
L. Xie, J. Tian, Y. Ouyang, X. Guo, W. Zhang, U.-P. Apfel, W. Zhang, R. Cao |
Water-Soluble Polymers with Appending Porphyrins as Bioinspired Catalysts for the Hydrogen Evolution Reaction |
Angew. Chem. Int. Ed. 59 (2020) 15844-15848 |
|
Research Area: II
|
|
C. Lorent, S. Katz, J. F. Duan, C. J. Kulka, G. Caserta, C. Teutloff, S. Yadav, U.-P. Apfel, M. Winkler, T. Happe, M. Horch, I. Zebger |
Shedding Light on Proton and Electron Dynamics in [FeFe] Hydrogenases |
J. Am. Chem. Soc. 142 (2020) 5493-5497 |
|
Research Area: II
|
|
L. Galazzo, G. Meier, M. H. Timachi, C. A. J. Hutter, M. A. Seeger, E. Bordignon |
Spin-labeled nanobodies as protein conformational reporters for electron paramagnetic resonance in cellular membranes |
Proc. Natl. Acad. Sci. U.S.A. 117 (2020) 2441-2448 |
|
Research Area: I
|
|
M. Teucher, M. Qi, N. Cati, H. Hintz, A. Godt, E. Bordignon |
Strategies to identify and suppress crosstalk signals in double electron?electron resonance (DEER) experiments with gadoliniumIII and nitroxide spin-label compounds |
J. Magn. Reson. 1 (2020) 285-299 |
|
Research Area: I
|
|
G. Zwaschka, I. Nahalka, A. Marchioro, Y. J. Tong, S. Roke, R. K. Campen |
Imaging the Heterogeneity of the Oxygen Evolution Reaction on Gold Electrodes Operando: Activity is Highly Local |
ACS Catal. 10 (2020) 6084-6093 |
|
Research Area: I
|
|
I. Nahalka, G. Zwaschka, R. K. Campen, A. Marchioro, S. Roke |
Mapping Electrochemical Heterogeneity at Gold Surfaces: A Second Harmonic Imaging Study |
J. Phys. Chem. C 124 (2020) 20021-20034 |
|
Research Area: I
|
|
F. Lapointe, M. Wolf, R. K. Campen, Y. Tong |
Probing the Birth and Ultrafast Dynamics of Hydrated Electrons at the Gold/Liquid Water Interface via an Optoelectronic Approach |
J. Am. Chem. Soc. 142 (2020) 18619-18627 |
|
Research Area: I
|
|
S. Timr, D. Gnutt, S. Ebbinghaus, F. Sterpone |
The Unfolding Journey of Superoxide Dismutase 1 Barrels under Crowding: Atomistic Simulations Shed Light on Intermediate States and Their Interaction with Crowders |
J. Phys. Chem. Lett. 11 (2020) 4206-4212 |
|
Research Area: III
|
|
M. Tu, S. Wannapaiboon, R. A. Fischer |
Inter-conversion between zeolith imidazolate frameworks: a dissolution-recrystallization process |
J. Mater. Chem. A 8 (2020) 13710-13717 |
|
Research Area: II
|
|
K.-S. Feichtner, F. Papp, M. Schmidt, M. Paassen, V. H.Gessner |
Carbene complex formation versus cyclometallation from a phosphoryl-tethered methanide ruthenium complex |
J. Organomet. Chem. 915 (2020) 121235 |
|
Research Area: II
|
|
K. Dilchert, T. Scherpf, V. H. Gessner |
Carbenoid-Mediated Formation and Activation of Element-Element and Element-Hydrogen Bonds |
Eur. J. Inorg. Chem. 2020 (2020) 4111-4115 |
|
Research Area: II
|
|
T. Scherpf, H. Steinert, A. Grossjohann, K. Dilchert, J. Tappen, I. Rodstein, V. H. Gessner |
Efficient Pd-Catalyzed Direct Coupling of Aryl Chlorides with Alkyllithium Reagents |
Angew. Chem. Int. Ed. 59 (2020) 20596-20603 |
|
Research Area: II
|
|
J. Tappen, I. Rodstein, K. McGuire, A. Grossjohann, J. Loeffler, T. Scherpf, V. H. Gessner |
Palladium Complexes Based on Ylide-Functionalized Phosphines (YPhos): Broadly Applicable High-Performance Precatalysts for the Amination of Aryl Halides at Room Temperature |
Chem. Eur. J. 26 (2020) 4281-4288 |
|
Research Area: II
|
|
C. Mohapatra, H. Darmandeh, H. Steinert, B. Mallick, K.-S. Feichtner, V. H. Gessner |
Synthesis of Low-Valent Dinuclear Group 14 Compounds with Element-Element Bonds by Transylidation |
Chem. Eur. J. 26 (2020) 15145-15149 |
|
Research Area: II
|
|
S. De, N. Sivendran, B. Maity, N. Pirkl, D. Koley, L. J. Goossen |
Dinuclear Pd-I Catalysts in Equlibrium Isomerizations: Mechanistic Understanding, in Silico Casting, and Catalyst Development |
ACS Catal. 10 (2020) 4517-4533 |
|
Research Area: II
|
|
A. M. Martinez, D. Hayrapetyan, T. van Lingen, M. Dyga, L. J. Goossen |
Taking electrodecarboxylative etherification beyond Hofer-Moest using a radical C-O coupling strategy |
Nat. Commun. 11 (2020) 4407 |
|
Research Area: II
|
|
S. Park, R. Barnes, Y. Lin, B.-j. Jeon, S. Najafi, K. T. Delaney, G. H. Fredrickson, J.-E. Shea, D. S. Hwang, S. Han |
Dehydration entropy drives liquid-liquid phase separation by molecular crowding |
Commun. Chem. 3 (2020) 83 |
|
Research Area: III
|
|
C.-T. Han, J. Song, T. Chan, C. Pruett, S. Han |
Electrostatic Environment of Proteorhodopsin Affects the pKa of Its Buried Primary Proton Acceptor |
Biophys. J. 118 (2020) 1838-1849 |
|
Research Area: I
|
|
J. Monroe, M. Barry, A. DeStefano, P. A. Gorturk, S. Jiao, D. Robinson-Brown, T. Webber, E. J. Crumlin, S. Han, S. Shell |
Water Structure and Properties at Hydrophilic and Hydrophobic Surfaces |
Annu. Rev. Chem. Biomol. Eng. 11 (2020) 523-557 |
|
Research Area: I
|
|
G.-F. Luo, Y. Biniuri, W.-H.Chen, J. Wang, E. Neumann, H.-B. Marjault, R. Nechushtai, M. Winkler, T. Happe, I. Willner |
Modelling Photosynthesis with Zn II -Protoporphyrin All-DNA G-Quadruplex/Aptamer Scaffolds |
Angew. Chem. Int. Ed. 59 (2020) 9163-9170 |
|
Research Area: II
|
|
O. Lampret, J. Duan, E. Hofmann, M. Winkler, F. A. Armstrong, T. Happe |
The roles of long-range proton-coupled electron transfer in the directionality and efficiency of [FeFe]-hydrogenases |
Proc. Natl. Acad. Sci. U.S.A. 117 (2020) 20520-20529 |
|
Research Area: II
|
|
E. M. Adams, O. Lampret, B. Koenig, T. Happe, M. Havenith |
Solvent dynamics play a decisive role in the complex formation of biologically relevant redox proteins |
Phys. Chem. Chem. Phys. 22 (2020) 7451-7459 |
|
Research Area: I
|
|
S. Karbalaei Khani, A. Marefat Khah, C. Haettig |
Comparison of Reaction Field Schemes for Coupling Continuum Solvation Models with Wave Function Methods for Excitation Energies |
J. Chem. Theory Comput. 16 (2020) 4554-4564 |
|
Research Area: I
|
|
A. Marefat Khah, P. Reinholdt, J. M. Haugaard Olsen, J. Kongsted, C. Haettig |
Avoiding Electron Spill-Out in QM/MM Calculations on Excited States with Simple Pseudopotentials |
J. Chem. Theory Comput. 16 (2020) 1373-1381 |
|
Research Area: I
|
|
A. Marefat Khah, P. Reinholdt, P. Nuernberger, J. Kongsted, C. Heattig |
Relaxation Dynamics of the Triazene Compound Berenil in DNA-Minor-Groove Confinement after Photoexcitation |
J. Chem. Theory Comput. 16 (2020) 5203-5211 |
|
Research Area: III
|
|
T. K. Roy, D. Mani, G. Schwaab, M. Havenith |
A close competition between O-H...O and O-H...pi hydrogen bonding: IR spectroscopy of anisole-methanol complex in helium nanodroplets |
Phys. Chem. Chem. Phys. 22 (2020) 22408-22416 |
|
Research Area: III
|
|
R. Schwan, C. Qu, D. Mani, N. Pal, G. Schwaab, J. M. Bowman, G. S. Tschumper, M. Havenith |
Oberservation of the Low-Frequency Spectrum of the Water Trimer as a Sensitive Test of the Water-Trimer Potential and the Dipole-Moment Surface |
Angew. Chem. Int. Ed. 59 (2020) 11399-11407 |
|
Research Area: III
|
|
F. Novelli, B. Guchhait, M. Havenith |
Towards Intense THz Spectroscopy on Water: Characterization of Optical Rectification by GaP, OH1, and DSTMS at OPA Wavelengths |
Materials 13 (2020) 1311 |
|
Research Area: I
|
|
F. Novelli, L. R. Pestana, K. C. Bennett, F. Sebastiani, E. M. Adams, N. Stavrias, T. Ockelmann, A. Colchero, C. Hoberg, G. Schwaab, T. Head-Gordon, M. Havenith |
Strong Anisotropy in Liquid Water upon Librational Excitation Using Terahertz Laser Fields |
J. Phys. Chem. B 124 (2020) 4989-5001 |
|
Research Area: I
|
|
V. Conti Nibali, S. Pezzotti, F. Sebastiani, D. R. Galimberti, G. Schwaab, M. Heyden, M.-P. Gaigeot, M. Havenith |
Wrapping up hydrophobic hydration - locality matters |
J. Phys. Chem. Lett. 11 (2020) 4809-4816 |
|
Research Area: I
|
|
F. Novelli, C. Y. Ma, N. Adhlakha, E. Adams, T. Ockelmann, D. Das Mahanta, P. Di Pietro, A. Perucchi, M. Havenith |
Nonlinear teraHertz transmission by liquid water at 1 THz |
Appl. Sci. 10 (2020) 5290 |
|
Research Area: I
|
|
F. Sebastiani, T. A. Bender, S. Pezzotti, W.-L. Li, G. Schwaab, R. G. Bergman, K. N. Raymond, F. D. Toste, T. Head-Gordon, M. Havenith |
An isolated water droplet in the aqueous solution of a supramolecular tetrahedral cage |
Proc. Natl. Acad. Sci. U.S.A. 117 (2020) 32954-32961 |
|
Research Area: III
|
|
F. Sebastiani, A. Vila Verde, M. Heyden, G. Schwaab, M. Havenith |
Cooperativity and ion pairing in magnesium sulfate aqueous solutions from the dilute regime to the solubility limit |
Phys. Chem. Chem. Phys. 22 (2020) 12140-12153 |
|
Research Area: I
|
|
J. Schnatwinkel, C. Herrmann |
The interaction strength of an intrinsically disordered protein domain with its binding partner is little affected by very different cosolutes |
Phys. Chem. Chem. Phys. 22 (2020) 27903-27911 |
|
Research Area: I
|
|
J. M. Holthoff, E. Engelage, R. Weiss, S. M. Huber |
Anti-Electrostatic Halogen Bonding |
Angew. Chem. Int. Ed. 59 (2020) 11150-11157 |
|
Research Area: II
|
|
J. Wolf, F. Huber, N. Erochok, F. Heinen, V. Guerin, C. Legault, S. F. Kirsch, S. M. Huber |
Activation of a metal-halogen bond by halogen bonding |
Angew. Chem. Int. Ed. 59 (2020) 16496-16500 |
|
Research Area: II
|
|
R. L. Sutar, E. Engelage, R. Stoll, S. M. Huber |
Bidentate Chiral Bis(imidazolium)-Based Halogen-Bond Donors: Synthesis and Applications in Enantioselective Recogniting and Catalysis |
Angew. Chem. Int. Ed. 59 (2020) 6806-6810 |
|
Research Area: II
|
|
D. Bulfield, E. Engelage, L. Mancheski, J. Stoesser, S. M. Huber |
Crystal Engineering with Multi-Point Halogen Bonding: Double Two-Point Donors and Acceptors at Work |
Chem. Eur. J. 26 (2020) 1567-1575 |
|
Research Area: II
|
|
E. Engelage, D. Reinhard, S. M. Huber |
Is There a Single Ideal Parameter for Halogen-Bonding-Based Lewis Acidity? |
Chem. Eur. J. 26 (2020) 3843-3861 |
|
Research Area: II
|
|
F. Heinen, E. Engelage, C. J. Cramer, S. M. Huber |
Hypervalent Iodine(III) Compounds as Biaxial Halogen Bond Donors |
J. Am. Chem. Soc. 142 (2020) 8633-8640 |
|
Research Area: II
|
|
M. Li, H. Chen, S. Li, G. Wang, F. Wei, X. Guo, H. Tu |
Active Self-Assembled Monolayer Sensors for Trace Explosive Detection |
Langmuir 36 (2020) 1462-1466 |
|
Research Area: III
|
|
L. Eberlein, F. B. Beierlein, N. J. R. van Eikema Hommes, A. Radadiya, J. Heil, S. A. Benner, T. Clark, S. M. Kast, N. G. Richards |
Tautomeric Equilibria of Nucleobases in the Hachimoji Expanded Genetic Alphabet |
J. Chem. Theory Comput. 16 (2020) 2766-2777 |
|
Research Area: I
|
|
N. Tielker, D. Tomazic, L. Eberlein, S. Guessregen, S. M. Kast |
The SAMPL6 challenge on predicting octanol-water partition coefficients from EC-RISM theory |
J. Comput. Aided Mol. Des. 34 (2020) 453-461 |
|
Research Area: I
|
|
R. Nissler, O. Bader, M. Dohmen, S. G. Walter, C. Noll, G. Selvaggio, U. Gross, S. Kruss |
Remote near infrared identification of pathogens with multiplexed nanosensors |
Nat. Commun. 11 (2020) 5995 |
|
Research Area: I
|
|
E. Burakova, S. K. Vasa, A. Klein, R. Linser |
Non-uniform sampling in quantitative assessment of heterogeneous solid-state NMR line shapes |
J. Biomol. NMR 74 (2020) 71-82 |
|
Research Area: I
|
|
K. Grohe, S. Patel, C. Hebrank, S. Medina, A. Klein, P. Rovo, S. K. Vasa, H. Singh, B. Voegeli, L. V. Schaefer, R. Linser |
Protein Motional Details Revealed by Complementary Structural Biology Techniques |
Structure 28 (2020) 1024-1034 |
|
Research Area: I
|
|
R. Properzi, P. S. J. Kaib, M. Leutzsch, G. Pupo, R. Mitra, C. Kanta De, L. Song, P. R. Schreiner, B. List |
Catalytic Enantiocontrol over a non-Classical Carbocation |
Nat. Chem. 12 (2020) 1174-1179 |
|
Research Area: II
|
|
H. Zhou, H. Y. Bae, M. Leutzsch, J. L. Kennemur, D. Becart, B. List |
The Silicon-Hydrogen Exchange Reaction: A Catalytic sigma-Bond Metathesis Approach to the Enantioselective Synthesis of Enol Silanes |
J. Am. Chem. Soc. 142 (2020) 13695-13700 |
|
Research Area: II
|
|
J. Szczesny, J. A. Birrell, F. Conzuelo, W. Lubitz, A. Ruff, W. Schuhmann |
Redox-Polymer-Based High-Current-Density Gas-Diffusion H2-Oxidation Bioanode Using [FeFe] Hydrogenase from Desulfovibrio desulfuricans in a Membrane-free Biofuel Cell |
Angew. Chem. Int. Ed. 59 (2020) 16506-16510 |
|
Research Area: III
|
|
M. Loipersberger, Y. Mao, M. Head-Gordon |
Variational Forward-Backward Charge Transfer Analysis Based on Absolutely Localized Molecular Orbitals: Energetics and Molecular Properties |
J. Chem. Theory Comput. 16 (2020) 1073-1089 |
|
Research Area: II
|
|
J. Akilavasan, F. Marlow |
Electrochemical Impedance Spectroscopy at Redox-Type Liquid/Liquid Interfaces: The Capacitance Lag |
J. Phys. Chem. C 124 (2020) 4101-4108 |
|
Research Area: I
|
|
P. Schienbein, D. Marx |
Assessing the properties of supercritical water in terms of structural dynamics and electronic polarization effects |
Phys. Chem. Chem. Phys. 22 (2020) 10462-10479 |
|
Research Area: III
|
|
C. Schran, J. Behler, D. Marx |
Automated Fitting of Neural Network Potentials at Coupled Cluster Accuracy: Protonated Water Clusters as Testing Ground |
J. Chem. Theory Comput. 16 (2020) 88-99 |
|
Research Area: III
|
|
F. Brieuc, C. Schran, F. Uhl, H. Forbert, D. Marx |
Converged quantum simulations of reactive solutes in superfluid helium: The Bochum perspective |
J. Chem. Phys. 152 (2020) 210901 |
|
Research Area: III
|
|
R. Topolnicki, F. Brieuc, C. Schran, D. Marx |
Deciphering High-order Structural Correlations within Fluxional Molecules from Classical and Quantum Configurational Entropy |
J. Chem. Theory Comput. 16 (2020) 6785-6794 |
|
Research Area: II
|
|
N. Kumar, D. Marx |
Deciphering the Self-Cleavage Reaction Mechanism of Hairpin Ribozyme |
J. Phys. Chem. B 124 (2020) 4906-4918 |
|
Research Area: III
|
|
R. Perez de Tudela, D. Marx |
Generating Excess Protons in Microsolvated Acid Clusters at Ambient Conditions: An Issue of Configurational Entropy versus Internal Energy |
Chem. Eur. J. 26 (2020) 11955-11959 |
|
Research Area: III
|
|
S. Imoto, D. Marx |
How Can Protons Migrate in Extremely Compressed Liquid Water? |
Phys. Rev. Lett. 125 (2020) 086001 |
|
Research Area: III
|
|
D. H. Patel, D. Marx, A. L. L. East |
Improving Yield and Rate of Acid-Catalyzed Deconstruction of Lignin by Mechanochemical Activation |
ChemPhysChem 21 (2020) 2660-2666 |
|
Research Area: III
|
|
P. Dopieralski, M. E. Zoloff Michoff, D. Marx |
Mechanochemical disulfide reduction reveals imprints of noncovalent sulfur...oxygen chalcogen bonds in protein-inspired mimics in aqueous solution |
Phys. Chem. Chem. Phys. 22 (2020) 25112-25117 |
|
Research Area: II
|
|
N. Kumar, D. Marx |
On the Adaptability of the Chemical Reaction of Hairpin Ribozyme to High Pressures |
J. Phys. Chem. Lett. 11 (2020) 9298-9303 |
|
Research Area: III
|
|
S. Ruiz-Barragan, D. Munoz-Santiburcio, S. Koerning, D. Marx |
Quantifying anisotropic dielectric response properties of nanoconfined water within graphene slit pores |
Phys. Chem. Chem. Phys. 22 (2020) 10833-10837 |
|
Research Area: III
|
|
N. Siemer, D. Munoz-Santiburcio, D. Marx |
Solvation-Enhanced Oxygen Activation at Gold/Titania Nanocatalysts |
ACS Catal. 10 (2020) 8530-8534 |
|
Research Area: I
|
|
P. Schienbein, D. Marx |
Supercritical Water is not Hydrogen Bonded |
Angew. Chem. Int. Ed. 59 (2020) 18578-18585 |
|
Research Area: III
|
|
A. A. Auer, V. A. Tran, B. Sharma, G. L. Stoychev, D. Marx, F. Neese |
A case study of density functional theory and domain-based local pair natural orbital coupled cluster for vibrational effects on EPR hyperfine coupling constants: vibrational perturbation theory versus ab initio molecular dynamics |
Mol. Phys. 118 (2020) e1797916 |
|
Research Area: I
|
|
S. Schraff, N. M. Kreienborg, J. Trampert, Y. Sun, A. Orthaber, C. Merten, F. Pammer |
Asymmetric chain-growth synthesis of polyisocyanide with chiral nickel precatalysts |
J. Polym. Sci. 58 (2020) 2221-2233 |
|
Research Area: II
|
|
L. Weirich, J. Magalhaes de Oliveira, C. Merten |
How many solvent molecules are required to solvate chiral 1,2-diols with hydrogen bonding solvents? A VCD spectroscopic study |
Phys. Chem. Chem. Phys. 22 (2020) 1525-1533 |
|
Research Area: I
|
|
L. Weirich, K. Blanke, C. Merten |
More complex, less complicated? Explicit solvation of hydroxyl groups for the analysis of VCD spectra |
Phys. Chem. Chem. Phys. 22 (2020) 12515-12523 |
|
Research Area: I
|
|
C. Merten |
Recent Advances in the Application of Vibrational Circular Dichroism Spectroscopy for the Characterization of Asymmetric Catalysts |
Eur. J. Org. Chem. 2020 (2020) 5892-5900 |
|
Research Area: II
|
|
T. Vermeyen, C. Merten |
Solvation and the secondary structure of a proline-containing dipeptide: insights from VCD spectroscopy |
Phys. Chem. Chem. Phys. 22 (2020) 15640-15648 |
|
Research Area: I
|
|
T. P. Golub, C. Merten |
Stereochemistry of the Reaction Intermediates of Prolinol Ether Catalyzed Reactions Characterized by Vibrational Circular Dichroism Spectroscopy |
Chem. Eur. J. 26 (2020) 2349-2353 |
|
Research Area: II
|
|
D. P. Demarque, S. Heinrich, F. Schulz, C. Merten |
Sensitivity of VCD spectroscopy for small structural and stereochemical changes of macrolide antibiotics |
Chem. Commun. 56 (2020) 10926-10929 |
|
Research Area: II
|
|
C. Bertram, P. Auburger, M. Bockstedte, J. Staehler, U. Bovensiepen, K. Morgenstern |
Impact of electron solvation on ice structures at the molecular scale |
J. Phys. Chem. Lett. 11 (2020) 1310-1316 |
|
Research Area: III
|
|
T. Tarnev, S. Cychy, C. Andronescu, M. Muhler, W. Schuhmann, Y.-T. Chen |
A universal nano-capillary based method of catalyst immobilization for liquid cell transmission electron microscopy / Eine universelle, auf Nanokapillaren basierende Methode zur Katalysatorimmobilisierung fuer die Fluessigzell-Transmissionselektronenmikroskopie |
Angew. Chem. Int. Ed. 59 (2020) 5586-5590 |
|
Research Area: I
|
|
A. R. Poerwoprajitno, L. Gloag, J. Watt, S. Cychy, S. Cheong, P. V. Kumar, T. M. Benedetti, C. Deng, K.-H. Wu, C. E. Marjo, D. L. Huber, M. Muhler, J. J. Gooding, W. Schuhmann, D.-W. Wang, R. D. Tilley |
Faceted Branched Nickel Nanoparticles with Tunable Branch Length for High-Activity Electrocatalytic Oxidation of Biomass / Facettierte verzweigte Nickel-Nanopartikel mit variierbarer Verzweigungslaenge fuer die hochaktive elektrokatalytische Oxidation von Biomasse |
Angew. Chem. Int. Ed. 59 (2020) 15487-15491 |
|
Research Area: I
|
|
A. Sirohiwal, R. Berraud-Pache, F. Neese, R. Izsak, D. A. Pantazis |
Accurate Computation of the Absorption Spectrum of Chlorophyll?a?with Pair Natural Orbital Coupled Cluster Methods |
J. Phys. Chem. B 124 (2020) 8761-8771 |
|
Research Area: I
|
|
R. Ghafarian Shirazi, D. A. Pantazis, F. Neese |
Performance of density functional theory and orbital-optimised second-order perturbation theory methods for geometries and singlet?triplet state splittings of aryl-carbenes |
Mol. Phys. 118 (2020) e1764644 |
|
Research Area: II
|
|
A. Sirohiwal, F. Neese, D. A. Pantazis |
Protein Matrix Control of Reaction Center Excitation in Photosystem II |
J. Am. Chem. Soc. 142 (2020) 18174-18190 |
|
Research Area: I
|
|
K. junge Puring, O. Evers, M. Prokein, D. Siegmund, F. Scholten, N. Moelders, M. Renner, B. Roldan Cuenya, M. Petermann, E. Weidner, U.-P. Apfel |
Assessing the Influence of Supercritical Carbon Dioxide on the Electrochemical Reduction to Formic Acid Using Carbon-Supported Copper Catalysts |
ACS Catal. 10 (2020) 12783-12789 |
|
Research Area: II
|
|
A. A. Oughli, S. Hardt, O. Ruediger, J. A. Birrell, N. Plumere |
Reactivation of sulfide-protected [FeFe] hydrogenase in a redox-active hydrogel |
Chem. Commun. 56 (2020) 9958-9961 |
|
Research Area: III
|
|
D. Buesen, H. Li, N. Plumere |
The electron as a probe to measure the thickness distributions of electroactive films |
Chem. Sci. 11 (2020) 937-946 |
|
Research Area: III
|
|
H. Li, U. Muenchberg, A. A. Oughli, D. Buesen, W. Lubitz, E. Freier, N. Plumere |
Suppressing hydrogen peroxide generation to achieve oxygen-insensitivity of a [NiFe] hydrogenase in redox active films |
Nat. Commun. 11 (2020) 920 |
|
Research Area: III
|
|
D. Pabsch, C. Held, G. Sadowski |
Modeling the CO2 Solubility in Aqueous Electrolyte Solutions Using ePC-SAFT |
J. Chem. Eng. Data 65 (2020) 5768-5777 |
|
Research Area: II
|
|
K. Wysoczanska, H. T. Do, G. Sadowski, E. A. Macedo, C. Held |
Partitioning of water-soluble vitamins in biodegradable aqueous two-phase systems: Electrolyte perturbed-chain statistical associating fluid theory predictions and experimental validation |
AIChE J. 66 (2020) e16984 |
|
Research Area: I
|
|
A. Kuusk, J. F. Neves, K. Bravo-Rodriguez, A. Gunnarsson, Y. B. Ruiz-Blanco, M. Ehrmann, H. M. Chen, I. Landrieu, E. Sanchez-Garcia, H. Boyd, C. Ottmann, R. G. Doveston |
Adoption of a Turn Conformation Drives the Binding Affinity of p53 C-Terminal Domain Peptides to 14-3-3 sigma |
ACS Chem. Biol. 15 (2020) 262-271 |
|
Research Area: II
|
|
M. Harms, M. M. W. Habib, S. Nemska, A. Nicolo, A. Gilg, N. Preising, P. Sokkar, S. Carmignani, M. Raasholm, G. Weidinger, G. Kizilsavas, M. Wagner, L. Staendker, A. H. Abadi, H. Jumaa, F. Kirchhoff, N. Frossard, E. Sanchez-Garcia, J. Muench |
An optimized derivative of an endogenous CXCR4 antagonist prevents atopic dermatitis and airway inflammation |
Acta Pharm. Sin. B 11 (2020) 2694-2708 |
|
Research Area: I
|
|
Y. B. Ruiz-Blanco, E. Sanchez-Garcia |
CL-FEP: An End-State Free Energy Perturbation Approach |
J. Chem. Theory Comput. 16 (2020) 1396-1410 |
|
Research Area: I
|
|
D. Schuetz, Y. B. Ruiz-Blanco, J. Muench, F. Kirchhoff, E. Sanchez-Garcia, J. A. Mueller |
Peptide and peptide-based inhibitors of SARS-CoV-2 entry |
Adv. Drug. Deliv. Rev. 167 (2020) 47-65 |
|
Research Area: II
|
|
A. Holch, R. Bauer, L.-R. Olari, A. A. Rodriguez, L. Staendker, N. Preising, M. Karacan, S. Wiese, P. Walther, Y. B. Ruiz-Blanco, E. Sanchez-Garcia, C. Schumann, J. Muench, B. Spellerberg |
Respiratory Beta-2-Microglobulin exerts pH dependent antimicrobial activity |
Virulence 11 (2020) 1402-1414 |
|
Research Area: II
|
|
E. Mendez-Vega, W. Sander, P. Hemberger |
Isomer-Selective Threshold Photoelectron Spectra of Phenylnitrene and Its Thermal Rearrangement Products |
J. Phys. Chem. A 124 (2020) 3836-3843 |
|
Research Area: II
|
|
T. Schleif, M. P. Merini, W. Sander |
The Mystery of the Benzene-Oxide/Oxepin Equilibrium - Heavy Atom Tunneling Reversed by Solvent Interactions |
Angew. Chem. Int. Ed. 59 (2020) 20318-20322 |
|
Research Area: III
|
|
T. Schleif, J. Tatchen, J. F. Rowen, F. Beyer, E. Sanchez-Garcia, W. Sander |
Heavy-Atom Tunneling in Semibullvalenes: How Driving Force, Substituents, and Environment Influence the Tunneling Rates |
Chem. Eur. J. 26 (2020) 10452-10458 |
|
Research Area: III
|
|
N. Hekmat, T. Vogel, Y. Wang, S. Mansourzadeh, F. Aslani, A. Omar, M. Hoffmann, F. Meyer, C. J. Saraceno |
Cryogenically cooled GaP for optical rectification at high excitation average powers |
Opt. Mater. Express 10 (2020) 2768-2782 |
|
Research Area: III
|
|
F. Meyer, T. Vogel, S. Ahmed, C. J. Saraceno |
Single-cycle, MHz-repetition rate THz source with 66 mW of average power |
Opt. Lett. 45 (2020) 2494-2497 |
|
Research Area: I
|
|
O. Fisette, G. F. Schroeder, L. V. Schaefer |
Atomistic structure and dynamics of the human MHC-I peptide-loading complex |
Proc. Natl. Acad. Sci. U.S.A. 117 (2020) 20597-20606 |
|
Research Area: I
|
|
H. Goeddeke, L. V. Schaefer |
Capturing Substrate Translocation in an ABC Exporter at the Atomic Level |
J. Am. Chem. Soc. 142 (2020) 12791-12801 |
|
Research Area: I
|
|
S. Wingbermuehle, L. V. Schaefer |
Capturing the Flexibility of a Protein-Ligand Complex: Binding Free Energies from Different Enhanced Sampling Techniques |
J. Chem. Theory Comput. 16 (2020) 4615-4630 |
|
Research Area: I
|
|
F. Hoffmann, F. A. A. Mulder, L. V. Schaefer |
Predicting NMR Relaxation of Proteins from Molecular Dynamics Simulations with Accurate Methyl Rotation Barriers |
J. Chem. Phys. 152 (2020) 84102 |
|
Research Area: I
|
|
H. Singh, C. K. Das, S. K. Vasa, K. Grohe, L. V. Schaefer, R. Linser |
The Active Site of a Prototypical "Rigid" Drug Target is Marked by Extensive Conformational Dynamics |
Angew. Chem. Int. Ed. 59 (2020) 22916-22921 |
|
Research Area: I
|
|
A. Ruff, F. Conzuelo, W. Schuhmann |
Bioelectrocatalysis as the basis for the design of enzyme-based biofuel cells and semi-artificial biophotoelectrodes |
Nat. Catal. 3 (2020) 214-224 |
|
Research Area: II
|
|
J. S. Stefano, F. Conzuelo, J. Masa, R. A. A. Munoz, W. Schuhmann |
Coupling electrochemistry with a fluorescence reporting reaction enabled by bipolar electrochemistry |
J. Electroanal. Chem. 872 (2020) 113921 |
|
Research Area: I
|
|
T. Loeffler, A. Savan, H. Meyer, M. Meischein, V. Strotkoetter, A. Ludwig, W. Schuhmann |
Design of high entropy alloy electrocatalysts by correlating configuration, adsorption energy distribution patterns and activity curves |
Angew. Chem. Int. Ed. 59 (2020) 5844-5850 |
|
Research Area: I
|
|
A. Ruff, W. Jaikaew, P. Khunkaewla, W. Schuhmann, A. Schulte |
Drug Release from Polymer Thin Films and Gel Pellets: Insights from Programmed Microplate Electroanalysis |
ChemPlusChem 85 (2020) 627-633 |
|
Research Area: III
|
|
J. Masa, C. Andronescu, W. Schuhmann |
Electrocatalysis as the Nexus for Sustainable Renewable Energy: The Gordian Knot of Activity, Stability, and Selectivity |
Angew. Chem. Int. Ed. 59 (2020) 15298-15312 |
|
Research Area: II
|
|
J. Szczesny, A. Ruff, A. R. Oliveira, I. A. C. Pereira, A. L. De Lacey, W. Schuhmann |
Electroenzymatic CO2 Fixation Using Redox Polymer/Enzyme-Modified Gas Diffusion Electrodes |
ACS Energy Lett. 5 (2020) 321-327 |
|
Research Area: II
|
|
Y. S. Lee, A. Ruff, R. Cai, K. Lim, W. Schuhmann, S. D. Minteer |
Electroenzymatic Nitrogen Fixation Using a MoFe Protein System Immobilized in an Organic Redox Polymer |
Angew. Chem. Int. Ed. 59 (2020) 16511-16516 |
|
Research Area: III
|
|
M. Marquitan, M. D. Mark, A. Ernst, A. Muhs, S. Herlitze, A. Ruff, W. Schuhmann |
Glutamate detection at the cellular level by means of polymer/enzyme multilayer modified carbon nanoelectrodes |
J. Mater. Chem. B 8 (2020) 3631-3639 |
|
Research Area: I
|
|
V. Hartmann, D. Harris, T. Bobrowski, A. Ruff, A. Frank, T. Guenther Pomorski, M. Roegner, W. Schuhmann, N. Adir, M. M. Nowaczyk |
Improved quantum efficiency in an engineered light harvesting/photosystem II super-complex for high current density biophotoanodes |
J. Mater. Chem. A 8 (2020) 14463-14471 |
|
Research Area: II
|
|
B. Alkan, D. Medina, J. Landers, M. Heidelmann, U. Hagemann, S. Salamon, C. Andronescu, H. Wende, C. Schulz, W. Schuhmann, H. Wiggers |
Influence of Fe content and low-temperature heating on spray-flame made LaCo1-xFexO3 nanoparticles for water oxidation catalysis |
ChemElectroChem 7 (2020) 2564-2574 |
|
Research Area: I
|
|
R. Bialek, K. Thakur, A. Ruff, M. R. Jones, W. Schuhmann, C. Ramanan, K. Gibasiewicz |
Insight into Electron Transfer from a Redox Polymer to a Photoactive Protein |
J. Phys. Chem. B 124 (2020) 11123-11132 |
|
Research Area: III
|
|
M. Riedel, A. Ruff, W. Schuhmann, F. Lisdat, F. Conzuelo |
Light-controlled imaging of biocatalytic reactions?via?scanning photoelectrochemical microscopy for multiplexed sensing |
Chem. Commun. 56 (2020) 5147-5150 |
|
Research Area: I
|
|
S. Moeller, S. Barwe, J. Masa, D. Wintrich, S. Seisel, H. Baltruschat, W. Schuhmann |
Online monitoring of electrochemical carbon corrosion in alkaline electrolytes by differential electrochemical mass spectrometry |
Angew. Chem. Int. Ed. 59 (2020) 1585-1589 |
|
Research Area: I
|
|
M. Marquitan, A. Ruff, M. Bramini, S. Herlitze, M. D.Mark, W. Schuhmann |
Polymer/enzyme-modified HF-etched carbon nanoelectrodes for single-cell analysis |
Bioelectrochemistry 133 (2020) 107487 |
|
Research Area: I
|
|
P. Wang, F. Zhao, V. Hartmann, M. M. Nowaczyk, A. Ruff, W. Schuhmann |
Reassessing the rationale behind herbicide biosensors: the case of a photosystem II/redox polymer-based bioelectrode |
Bioelectrochemistry 136 (2020) 107597 |
|
Research Area: III
|
|
A. Ruff, J. Szczesny, M. Vega, S. Zacarias, P. M. Matias, S. Gounel, N. Mano, I. A. C. Pereira, W. Schuhmann |
Redox polymer wired [NiFeSe] hydrogenase variants with enhanced O2 stability for membrane-free H2/O2 biofuel cells |
ChemSusChem 13 (2020) 3627-3635 |
|
Research Area: III
|
|
J. Wordsworth, T. Benedetti, A. Alinezhad, R. Tilley, M. Edwards, W. Schuhmann, J. J. Gooding |
The importance of nanoscale confinement on electrocatalytic performance |
Chem. Sci. 11 (2020) 1233-1240 |
|
Research Area: III
|
|
O. A. Krysiak, J. R. C. Junqueira, F. Conzuelo, T. Bobrowski, P. Wilde, A. Wysmolek, W. Schuhmann |
Tuning light-driven water splitting efficiency of Mo-doped BiVO4 by means of Ni-, Fe-, Cr-oxides co-catalysts |
ChemPlusChem 85 (2020) 327-333 |
|
Research Area: I
|
|
M. Elbers, C. Sternemann, K. Julius, M. Paulus, G. Surmeier, N. Konig, J. Nase, J. Bolle, R. Wagner, T. Irifune, M. Tolan |
Pressure stability of the first hydration shell of yttrium in aqueous YCl3 solution |
High Press. Res. 40 (2020) 194-204 |
|
Research Area: III
|
|
C. Rurainsky, A. Garzon Manjon, F. Hiege, Y.-T. Chen, C. Scheu, K. Tschulik |
Electrochemical dealloying as a tool to tune the porosity, composition and catalytic activity of nanomaterials |
J. Mater. Chem. A 8 (2020) 19405-19413 |
|
Research Area: I
|
|
Z. Liu, S. Li, J. Yang, X. Tan, C. Yu, C. Zhao, X. Han, H. Huang, G. Wan, Y. Liu, K. Tschulik, J. Qiu |
Ultrafast Construction of Oxygen-Containing Scaffold over Graphite for Trapping Ni2+ into Single Atom Catalysts |
ACS Nano 14 (2020) 11662-11669 |
|
Research Area: I
|
|
D. Siegmund, N. Blanc, M. Smialkowski, K. Tschulik, U.-P. Apfel |
Metal-Rich Chalcogenides for Electrocatalytic Hydrogen Evolution - Activity of Electrodes and Bulk Materials |
ChemElectroChem 7 (2020) 1514-1527 |
|
Research Area: I
|
|
K. Xie, M. Varatniskaya, A. Maghnouj, V. Bader, K. F. Winklhofer, S. Hahn, L. I. Leichert |
Activation leads to significant shift in the intracellular redox homeostasis of neutrophil-like cells |
Redox Biol. 28 (2020) 101344 |
|
Research Area: I
|
|
G. Dittmar, K. F. Winklhofer |
Linear Ubiquitin Chains: Cellular Functions and Strategies for Detection and Quantification |
Front. Chem. 7 (2020) 00915 |
|
Research Area: I
|
|
V. Bader, K. F. Winklhofer |
PINK1 and Parkin: team players in stress-induced mitophagy |
Biol. Chem. 401 (2020) 891-899 |
|
Research Area: III
|
|
V. Bader, F. Winklhofer |
Mitochondria at the interface between neurodegeneration and neuroinflammation |
Semin. Cell Dev. Biol. 99 (2020) 163-171 |
|
Research Area: III
|
|
J. Meschede, M. Sadic, N. Furthmann, T. Miedema, D. A. Sehr, A. K., Mueller-Rischart, V. Baderm L. A., Berlemann, A. Schlierf, K. Barkovits, B. Kachholz, K. Rittinger, F. Ikeda, K. Marcus, L. Schaefer, J. Tatzelt, K. F. Winklhofer |
The parkin-coregulated gene product PACRG promotes TNF signaling by stabilizing LUBAC |
Sci. Signal. 13 (2020) eaav1256 |
|
Research Area: I
|
|
R. Oliva, S. Banerjee, H. Cinar, C. Ehrt, R. Winter |
Alteration of Protein Binding Affinities by Aqueous Two-Phase Systems Revealed by Pressure Perturbation |
Sci. Rep. 10 (2020) 8074 |
|
Research Area: III
|
|
S. K. Mukherjee, J.-M. Knop, S. Moebitz, R. Winter |
Alteration of the Conformational Dynamics of a DNA Hairpin by alpha-Synuclein in the Presence of Aqueous Two-Phase Systems |
Chem. Eur. J. 26 (2020) 10987-10991 |
|
Research Area: III
|
|
T. O. Paulisch, S. Bornemann, M. Herzog, S. Kudruk, L. Roling, A. L. Linard Matos, H.-J. Galla, V. Gerke, R. Winter, F. Glorius |
An Imidazolium-Based Lipid Analogue as a Gene Transfer Agent |
Chem. Eur. J. 26 (2020) 17176-17182 |
|
Research Area: III
|
|
L. Li, S. Moebitz, R. Winter |
Characterization of the Spatial Organization of Raf Isoforms Interacting with K-Ras4B in the Lipid Membrane |
Langmuir 36 (2020) 5944-5953 |
|
Research Area: I
|
|
S. Gault, M. W. Jaworek, R. Winter, C. Cockell |
High pressures increase alpha-chymotrypsin enzyme activity under perchlorate stress |
Commun. Biol. 3 (2020) 550 |
|
Research Area: III
|
|
M. Herzog, T. Tiso, L. M. Blank, R. Winter |
Interaction of rhamnolipids with model biomembranes of varying complexity |
Biochim. Biophys. Acta Biomembr. 1862 (2020) 183431 |
|
Research Area: I
|
|
R. Oliva, S. Banerjee, H. Cinar, R. Winter |
Modulation of enzymatic activity by aqueous two-phase systems and pressure - rivalry between kinetic constants |
Chem. Commun. 56 (2020) 395-398 |
|
Research Area: III
|
|
R. Oliva, S. K. Mukherjee, Z. Fetahaj, S. Moebitz, R. Winter |
Perturbation of Liquid Droplets of P-granule Protein LAF-1 by the Antimicrobial Peptide LL-III |
Chem. Commun. 56 (2020) 11577-11580 |
|
Research Area: III
|
|
H. Cinar, R. Oliva, Y.-H. Lin, X. Chen, M. Zhang, H. S. Chan, R. Winter |
Pressure Sensitivity of SynGAP/PSD-95 Condensates as a Model for Postsynaptic Densities and ist Biophysical and Neurological Ramifications |
Chem. Eur. J. 26 (2020) 11024-11031 |
|
Research Area: III
|
|
J.-M. Knop, S. K. Mukherjee, R. Oliva, S. Moebitz, R. Winter |
Remodeling of the Conformational Dynamics of Noncanonical DNA Structures by Monomeric and Aggregated alpha-Synuclein |
J. Am. Chem. Soc. 142 (2020) 18299-18303 |
|
Research Area: I
|
|
M. W. Jaworek, S. Moebitz, M. Gao, R. Winter |
Stability of the chaperonin system GroEL-GroES under extreme environmental conditions |
Phys. Chem. Chem. Phys. 22 (2020) 3734-3743 |
|
Research Area: III
|
|
H. Cinar, R. Winter |
The effects of cosolutes and crowding on the kinetics of protein condensate formation based on liquid?liquid phase separation: a pressure-jump relaxation study |
Sci. Rep. 10 (2020) 17245 |
|
Research Area: III
|
|
L. Ostermeier, R. Olivia, R. Winter |
The multifaceted effects of DMSO and high hydrostatic pressure on the kinetic constants of hydrolysis reactions catalyzed by alpha-chymotrypsin |
Phys. Chem. Chem. Phys. 22 (2020) 16325-16333 |
|
Research Area: III
|
|
T. Pongatz, P. Kibies, L. Eberlein, N. Tielker, C. Hoelzl, S. Imoto, M. B. Erlach, S. Kurrmann, P. H. Schummel, M. Hofmann, O. Reisner, R. Winter, W. Kremer, H. R. Kalbitzer, D. Marx, D. Horinek, S. M. Kast |
Pressure-dependent electronic structure calculations using integral equation-based solvation models |
Biophys. Chem. 257 (2020) 106258 |
|
Research Area: III
|
|
T. Weil, R. Gross, A. Roecker, K. Bravo-Rodriguez, C. Heid, A. Sowislok, M.-H. Le, N. Erwin, M. Dwivedi, S. M. Bart, P. Bates, L. Wettstein, J. A. Mueller, M. Harms, K. Sparrer, Y. B. Ruiz-Blanco, C. M. Stuerzel, J. von Einem, S. Lippold, C. Read, P. Walther, M. Hebel, F. Kreppel, F.-G. Klaerner, G. Bitan, M. Ehrmann, T. Weil, R. Winter, T. Schrader, J. Shorter, E. Sanchez-Garcia, J. Muench |
Supramolecular Mechanism of Viral Envelope Disruption by Molecular Tweezers based Lipid Analogue as Gene Transfer Agent |
J. Am. Chem. Soc. 142 (2020) 17024-17038 |
|
Research Area: II
|
|
S. Gonglach, S. Paul, M. Haas, F. Pilwein, S. S. Screejith, S. Barman, R. De, S. Muellegger, P. Gerschel. U.-P. Apfel, H. Coskun, A, Aljabour, P. Stadler, W. Schoefberger, S. Roy |
Molecular cobalt corrole complex for the heterogeneous electrocatalytic reduction of carbon dioxide |
Nat. Commun. 10 (2019) 3864 |
|
Research Area: I
|
|
D. Tetzlaff, C. Simon, D. S. Achilleos, M. Smialkowski, K. Junge Puring, A. Bloesser, S. Piontek, H. Kasap, D. Siegmund, E. Reisner, R. Marschall, U.-P. Apfel |
FexNi9-xS8 (x = 3-6) as potential photocatalysts for solar-driven hydrogen production? |
Faraday Discuss. 215 (2019) 216-226 |
|
Research Area: I
|
|
S. Mebs, J. Duan, F. Wittkamp, S. T. Stripp, T. Happe, U.-P. Apfel, M. Winkler, M. Haumann |
Differential Protonation at the Catalytic Six-Iron Cofactor of [FeFe]-Hydrogenase Revealed by 57FE Nuclear Resonance X-ray Scattering and Quantum Mechanics/Molecular Mechanics Analyses |
Inorg. Chem. 58 (2019) 4000-4013 |
|
Research Area: II
|
|
J. Duan, S. Mebs, K. Laun, F. Wittkamp, J. Heberle, T. Happe, E. Hofmann, U.-P. Apfel, M. Winkler, M. Senger, M. Haumann, S. T. Stripp |
Geometry of the Catalytic Active Site in [FeFe]-Hydrogenase Is Determiined by Hydrogen Bonding and Proton Transfer |
ACS Catal. 9 (2019) 9140-9149 |
|
Research Area: II
|
|
M. Senger, V. Eichmann, K. Laun, J. Duan, F. Wittkamp, G. Knoer, U.-P. Apfel, T. Happe, M. Winkler, J. Heberle, S. T. Stripp |
How [FeFe]-Hydrogenase Facilitates Bidirectional Proton Transfer |
J. Am. Chem. Soc. 141 (2019) 17394-17403 |
|
Research Area: II
|
|
J. Esselborn, L. Kertess, U.-P. Apfel, E. Hofmann, T. Happe |
Loss of Specific Active-Site Iron Atoms in Oxygen-Exposed [FeFe]-Hydrogenase Determined by Detailed X-ray Structure Analyses |
J. Am. Chem. Soc. 141 (2019) 17721-17728 |
|
Research Area: II
|
|
M. Smialkowski, D. Siegmund, K. Pellumbi, L. Hensgen, H. Antoni, M. Muhler, U.-P. Apfel |
Seleno-analogues of pentlandites (Fe4.5 Ni4.5 S8-Y Sey, Y = 1-6): tuning bulk Fe/Ni sulphoselenides for hydrogen evolution |
Chem. Commun. 55 (2019) 8792-9795 |
|
Research Area: I
|
|
J. Masa, S. Piontek, P. Wilde, H. Antoni, T. Eckhard, Y.-T. Chen, M. Muhler, U.-P. Apfel, W. Schuhmann |
Ni-Metalloid (B, Si, P, As, and Te) Alloys as Water Oxidation Electrocatalyst |
Adv. Energy Mater. 9 (2019) 1900796 |
|
Research Area: I
|
|
L. Iffland, A. Khedkar, A. Petuker, M. Lieb, F. Wittkamp, M. van Gastel, M. Roemelt, U.-P. Apfel |
Solvent-Controlled CO2 Reduction by a Triphos-Iron Hydride Complex |
Organometallics 38 (2019) 289-299 |
|
Research Area: II
|
|
M. Hellstroem, V. Quaranta, J. Behler |
One-dimensional vs. two-dimensional proton transport processes at solid-liquid zinc-oxide-water interfaces |
Chem. Sci. 10 (2019) 1323-123 |
|
Research Area: I
|
|
V. Quaranta, J. Behler, M. Hellstroem |
Structure and Dynamics of the Liquid-Water/Zinc-Oxide Interface from Machine Learning Potential Simulations |
J. Phys. Chem. C 123 (2019) 1293-1304 |
|
Research Area: I
|
|
S. Bleicken, T. E. Assafa, H. Zhang, C. Elsner, I. Ritsch, M. Pink, S. Rajca, G. Jeschke, A. Rajca, E. Bordignon |
gem-Diethyl Pyrroline Nitroxide Spin-Labels: Synthesis, EPR Characterization, Rotamer Libraries and Biocompatibility |
ChemistryOpen 8 (2019) 1057-1065 |
|
Research Area: I
|
|
C. A. J. Hutter, M. H. Timachi, L. M. Huerlimann, I. Zimmermann, P. Egloff, H. Goeddeke, S. Kucher, S. Stefanic, M. Karttunen, L. V. Schaefer, E. Bordignon, M. A. Seege |
The extracellular gate shapes the energy profile of an ABC exporter |
Nat. Commun. 10 (2019) 2260 |
|
Research Area: II
|
|
M. Teucher, H. Zhang, V. Bader, K. F. Winklhofer, A. J. Garcia-Saez, A. Rajca, S. Bleicken, E. Bordignon |
A new perspective on membrane-embedded BAX oligomers using DEER and bioresistant orthogonal spin labels |
Sci. Rep. 9 (2019) 13013 |
|
Research Area: I
|
|
T. R. Schulte, J. J. Holstein, G. H. Clever |
Chiral Self-Discrimination and Guest Recognition in Helicene-Based Coordination Cages |
Angew. Chem. Int. Ed. 58 (2019) 5562-5566 |
|
Research Area: II
|
|
P. M. Punt, G. H. Clever |
Imidazole-modified G-quadruplex DNA as Metal-triggered Peroxidase |
Chem. Sci. 10 (2019) 2513-2518 |
|
Research Area: II
|
|
R.-J. Li, J. Holstein, W. Hiller, J. Andreasson, G. H. Clever |
Mechanistic Interplay between Light Switching and Guest Binding in Photochromic [Pd(2)Dithienylethene(4)] Coordination Cages |
J. Am. Chem. Soc. 141 (2019) 2097-2103 |
|
Research Area: II
|
|
B. Chen, J. J. Holstein, S. Horiuchi, W. G. Hiller, G. H. Clever |
Pd(II) Coordination Sphere Engineering: Pyridine Cages, Quinoline Bowls, and Heteroleptic Pills Binding One or Two Fullerenes |
J. Am. Chem. Soc. 141 (2019) 8907-8913 |
|
Research Area: II
|
|
P. M. Punt, G. H. Clever |
Tailored Transition-Metal Coordination Environments in Imidazole-Modified DNA G-Quadruplexes |
Chem. Eur. J. 25 (2019) 13987-13993 |
|
Research Area: II
|
|
B. Chen, S. Horiuchi, J. J. Holstein, J. Tessarolo, G. H. Clever |
Tunable Fullerene Affinity of Cages, Bowls and Rings Assembled by Pd(II) Coordination Sphere Engineering |
Chem. Eur. J. 25 (2019) 14821-14927 |
|
Research Area: II
|
|
D. Gnutt, L. Sistemich, S. Ebbinghaus |
Protein Folding Modulation in Cells Subject to Differentiation and Stress |
Front. Mol. Biosci. 6 (2019) 38 |
|
Research Area: III
|
|
D. Iqbal, J. Rechmann, A. Bashir, A. Sarfaz, A. Altin, A. Erbe |
Cathodic delamination kinetics of thin polystyrene model coatings bound to zinc via organosilanes |
Werkst. Korros. 70 (2019) 481-491 |
|
Research Area: I
|
|
S. Wannapaiboon, A. Schneemann, I. Hante, M. Tu, K. Epp, A. L. Semrau, C. Sternemann, M. Paulus, S. J. Baxter, G. Kieslich, R. A. Fischer |
Control of structural flexibility of layered-pillared metal-organic frameworks anchored at surfaces |
Nat. Commun. 10 (2019) 346 |
|
Research Area: III
|
|
C. Mohapatra, L. Scharf, T. Scherpf, B. Mallick, K.-S. Feichtner, C. Schwarz, V. H. Gessner |
Isolation of a Diylide-Stabilized Stannylene and Germylene: Enhanced Donor Strength through Coplanar Lone Pair Alignment |
Angew. Chem. Int. Ed. 58 (2019) 7459-7463 |
|
Research Area: II
|
|
C. Schwarz, L. T. Scharf, T. Scherpf, J. Weismann, V. H. Gessner |
Isolation of the Metalated Ylide [Ph3P-C-CN]M (M = Li, Na, K): Influence of the Metal Ion on the Structure and Bonding Situation |
Chem. Eur. J. 25 (2019) 2793-2802 |
|
Research Area: II
|
|
C. Schwarz, J. Handelmann, D. M. Baier, A. Ouissa, V. H. Gessner |
Mono- and diylide-substituted phosphines (Yphos): impact of the ligand properties on the catalytic activity in gold(I)-catalysed hydroaminations |
Catal. Sci. Technol. 9 (2019) 6808-6815 |
|
Research Area: II
|
|
Y. Ou, L. J. Goossen |
Copper-Mediated Synthesis of (Diethylphosphono)difluoromethyl Thioethers from Diazonium Salts, NaSCN, and TMS-CF2PO(OEt)2 |
Asian J. Org. Chem. 8 (2019) 650-653 |
|
Research Area: II
|
|
M. Pichette Drapeau, J. Bahri, D. Lichte, L. J. Goossen |
Decarboxylative ipso Amination of Activated Benzoic Acids |
Angew. Chem. Int. Ed. 58 (2019) 892-896 |
|
Research Area: II
|
|
N. Pirkl, A. Del Grosso, B. Mallick, A. Doppiu, L. J. Goossen |
Dihalogen-bridged NHC-palladium(I) dimers: synthesis, characterisation and applications in cross-coupling reactions |
Chem. Commun. 55 (2019) 5275-5278 |
|
Research Area: II
|
|
M. Dyga, D. Hayrapetyan, R. Rit, L. J. Goossen |
Electrochemical ipso-Thiocyanation of Arylboron Compounds |
Adv. Synth. Catal. 361 (2019) 3548-3553 |
|
Research Area: II
|
|
G. Zhang. Z. Hu, G. Bertoli, L. J. Goossen |
Iridium-Catalyzed Synthesis of Substituted Indanones from Aromatic Carboxylates and Unsaturated Ketones |
ACS Catal. 9 (2019) 8153-8158 |
|
Research Area: II
|
|
J. Pollini, W. M. Pankau, L. J. Goossen |
Isomerizing Olefin Metathesis |
Chem. Eur. J. 25 (2019) 7416-7425 |
|
Research Area: II
|
|
Y. Gao, Y. Ou, L. J. Goossen |
Pd-Catalyzed Synthesis of Vinyl Arenes from Aryl Halides and Acrylic Acid |
Chem. Eur. J. 25 (2019) 8709-8712 |
|
Research Area: II
|
|
G. Zhang, Z. Hu, F. Belitz, Y. Ou, N. Pirkl, L. J. Goossen |
Rhodium-Catalyzed Annelation of Benzoic Acids with alpha,beta-Unsaturated Ketones with Cleavage of C-H, CO-OH, and C-C Bonds / Rhodium-katalysierte Anellierung von Benzoesaeuren mit alpha,beta-ungesaettigten Ketonen durch C-H-, CO-OH- und C-C- Bindungsspaltung |
Angew. Chem. Int. Ed. 58 (2019) 6435-6439 |
|
Research Area: II
|
|
P. Weber, C. K. Rank, E. Yalcinkaya, M. Dyga, T. van Lingen, R. Schmid, F. W. Patureau, L. J. Goossen |
Rhodium-catalyzed ortho-Arylation of (Hetero)aromatic Acids |
Adv. Synth. Catal. 361 (2019) 3925-3929 |
|
Research Area: II
|
|
Z. Hu, X.-Q. Hu, G. Zhang, L. J. Goossen |
Ring-Opening Ortho-C-H- Allylation of Benzoic Acids with Vinylcyclopropanes: Merging Catalytic C-H and C-C Activation Concepts |
Org. Lett. 21 (2019) 6770-6773 |
|
Research Area: II
|
|
P. Weber, T. Scherpf, I. Rodstein, D. Lichte, L. T. Scharf, L. J. Goossen, V. H. Gessner |
A Highly Active Ylide-Functionalized Phosphine for Palladium-Catalyzed Aminations of Aryl Chlorides / Ein hochaktives, Ylid-funktionalisiertes Phosphan fuer die palladium-katalysierte Aminierung von Arylchloriden |
Angew. Chem. Int. Ed. 58 (2019) 3203-3207 |
|
Research Area: II
|
|
X.-Q. Hu, D. Lichte, I. Rodstein, P. Weber, A.-K. Seitz, T. Scherpf, V. H. Gessner, L. J. Goossen |
Ylide-Functionalized Phospine (Yphos) - Palladium Catalysts: Selective Monoarylation of Alkyl Ketones with Aryl Chlorides |
Org. Lett. 21 (2019) 7558-7562 |
|
Research Area: II
|
|
M. S. Andrae, L. Schifferer, C. H. Pollok, C. Merten, L. J. Goossen, J.-Q. Yu |
Enantio- and Diastereoswitchable C-H Arylation of Methylene Groups in Cycloalkanes |
Chem. Eur. J. 25 (2019) 8503-8507 |
|
Research Area: II
|
|
J. M. Franck, S. Han |
Chapter Five - Overhauser Dynamic Nuclear Polarization for the Study of Hydration Dynamics, Explained |
In Methods in Enzymology edited by A. J. Wand 615 (2019) 131-175 |
|
Research Area: I
|
|
M. Lin, N. K. Pandey, R. Barnes, S. Han, R. Langen |
Structure of Membrane-Bound Huntingtin Exon 1 Reveals Membrane Interaction and Aggregation Mechanisms |
Structure 27 (2019) 1570-1580 |
|
Research Area: I
|
|
G.-F. Luo, Y. Biniuri, W.-H. Chen, E. Neumann, M. Fadeev, H.-B. Marjault, A. Bedi, O. Gidron, R. Nechushtai, D. Stone, T. Happe, I. Willner |
Artificial Photosynthesis with Electron Acceptor/Photosensitizer-Aptamer Conjugates |
Nano Lett. 19 (2019) 6621-6628 |
|
Research Area: II
|
|
O. Lampret, J. Esselborn, R. Haas, A. Rutz, R. L. Booth, L. Kertess, F. Wittkamp, C. F. Megarity, F. A. Armstrong, M. Winkler, T. Happe |
The final steps of [FeFe]-hyrogenase maturation |
Proc. Natl. Acad. Sci. U.S.A. 116 (2019) 15802-15810 |
|
Research Area: II
|
|
J. W. Sidabras, J. Duan, M. Winkler, T. Happe, R. Hussein, A. Zouni, D. Suter, A. Schnegg, W. Lubitz, E. J. Reijerse |
Extending electron paramagnetic resonance to nanoliter volume protein single crystals using a self-resonant microhelix |
Sci. Adv. 5 (2019) eaay1394 |
|
Research Area: I
|
|
S. Karbalaei Khani, R. Faber, F. Santoro, C. Haettig, S. Coriani |
UV Absorption and Magnetic Circular Dichroism Spectra of Purine, Adenine, and Guanine: A Coupled Cluster Study in Vacuo and in Aqueous Solution |
J. Chem. Theory Comput. 15 (2019) 1242-1254 |
|
Research Area: II
|
|
D. Mani, N. Pal, M. Smialkowski, C. Beakovic, G. Schwaab, M. Havenith |
Accessing different binding sites of a multifunctional molecule: IR spectroscopy of propargyl alcohol-water complexes in helium droplets |
Phys. Chem. Chem. Phys. 21 (2019) 20582-20587 |
|
Research Area: I
|
|
S. R. Alfarano, H. Vondracek, F. Sebastiani F. Novelli, C. Hoberg, I. Kolling, J.-B. Brubach, P. Roy, G. Schwaab, M. Havenith |
Does hydrated glycine act as solidification nucleus at multi-kilobar conditions? |
Biophys. Chem. 253 (2019) 106215 |
|
Research Area: III
|
|
C. Hoberg, P. Balzerowski, M. Havenith |
Integration of a rapid-scanning technique into THz time-domain spectrometers for nonlinear THz spectroscopy measurements |
AIP Adv. 9 (2019) 035348 |
|
Research Area: I
|
|
G. Schwaab, F. Sebastiani. M. Havenith |
Ion hydration and ion pairing as probed by THz spectroscopy / Untersuchung von Ionenhydratation und Ionenpaarbildung mittels THz-Spektroskopie |
Angew. Chem. Int. Ed. 58 (2019) 3000-3013 |
|
Research Area: II
|
|
R. Schwan, C. Qu, D. Mani, N. Pal, L. van der Meer, B. Redlich, C. Leforestier, J. Bowman, G. Schwaab, M. Havenith |
Observation of the Low-Frequency Spectrum of the Water Dimer as a Sensitive Test of the Water Dimer Potential and Dipole Moment Surfaces |
Angew. Chem. Int. Ed. 58 (2019) 13119-13126 |
|
Research Area: I
|
|
S. Funke, F. Sebastiani, G. Schwaab, M. Havenith |
Spectroscopic fingerprints in the low frequency spectrum of ice (Ih), clathrate hydrates, supercooled water, and hydrophobic hydration reveal similarities in the hydrogen bond network motifs |
J. Chem. Phys. 150 (2019) 224505 |
|
Research Area: I
|
|
H. Vondracek, S. Alfarano, C. Hoberg, I. Kolling, F. Novelli, F. Sebastiani, J. B. Brubach, P. Roy, G. Schwaab, M. Havenith |
Urea's match in the hydrogen-bond network? A high pressure THz study |
Biophys. Chem. 254 (2019) 106240 |
|
Research Area: III
|
|
F. Novelli, M. B. Lopez, G. Schwaab, B. Roldan Cuenya, M. Havenith |
Water Solvation of Charged and Neutral Gold Nanoparticles |
J. Phys. Chem. B 123 (2019) 6521-6528 |
|
Research Area: I
|
|
D. Mani, R. Perez de Tudela, R. Schwan, N. Pal, S. Koerning, H. Forbert, B. Redlich, A. F. G. van der Meer, G. Schwaab, D. Marx, M. Havenith |
Acid solvation versus dissociation at "stardust conditions": Reaction sequence matters |
Sci. Adv. 5 (2019) eaav8179 |
|
Research Area: II
|
|
K. Lotz, A. Wuetscher, H. Duedder, C. M. Berger, C. Russo. K. Mukherjee, G. Schwaab, M. Havenith, M. Muhler |
Tuning the Properties of Iron-Doped Porous Graphitic Carbon Synthesized by Hydrothermal Carbonization of Cellulose and Subsequent Pyrolysis |
ACS Omega 4 (2019) 4448-4460 |
|
Research Area: III
|
|
M. Heyden |
Heterogeneity of water structure and dynamics at the protein-water interface |
J. Chem. Phys. 150 (2019) 094701 |
|
Research Area: I
|
|
D. Gnutt, S. Timr, J. Ahlers, B. Koenig, E. Manderfeld, M. Heyden, F. Sterpone, S. Ebbinghaus |
Stability Effect of Quinary Interactions Reversed by Single Point Mutations |
J. Am. Chem. Soc. 141 (2019) 4660-4669 |
|
Research Area: I
|
|
B. B. Majumdar, V. Prytkova, E. Wong, A. Freites, D. Tobias, M. Heyden |
Role of Conformational Flexibility in Monte Carlo Simulations of Many-Protein Systems |
J. Chem. Theory Comput. 15 (2019) 1399-1408 |
|
Research Area: I
|
|
S. Capponi, S. White, D. Tobias, M. Heyden |
Structural Relaxation Processes and Collective Dynamics of Water in Biomolecular Environments |
J. Phys. Chem. B 123 (2019) 480-486 |
|
Research Area: I
|
|
P. Wonner, A. Dreger, L. Vogel, E. Engelage, S. M. Huber |
Chalcogen Bonding Catalysis of a Nitro-Michael Reaction |
Angew. Chem. Int. Ed. 58 (2019) 16923-16927 |
|
Research Area: II
|
|
L. Vogel, P. Wonner, S. M. Huber |
Chalcogen Bonding: An Overview / Chalkogenbruecken: eine Uebersicht |
Angew. Chem. Int. Ed. 58 (2019) 1880-1891 |
|
Research Area: II
|
|
J. Fassunke, C. Heydt, S. Michels, B. va Veggel, F. Mueller, M. Keul, M. Dammert, A. Schmitt, E. Smit, S. Kast, J. Wolf, R. Buettner, M. L. Sos, D. Rauh, S. Merkelbach-Bruse |
New insights into acquired resistance mechanisms to third-generation EGFR tyrosine kinase inhibitor therapy in lung cancer |
Ann. Oncol. 30 (2019) II51 |
|
Research Area: I
|
|
N. Tielker, L. Eberlein, C. Chodun, S. Guessregen, S. M. Kast |
pKa calculations for tautomerizable and conformationally flexible molecules: partition function vs. state transition approach |
J. Mol. Model 25 (2019) 139 |
|
Research Area: I
|
|
S. K. Vasa, H. Singh, K. Grohe, R. Linser |
Assessment of a Large Enzyme-Drug Complex by Proton-Detected Solid-State NMR Spectroscopy without Deuteration / Charakterisierung eines grossen Enzym-Wirkstoff-Komplexes mittels protonendetektierter Festkoerper-NMR ohne Deuterierung |
Angew. Chem. Int. Ed. 58 (2019) 5758-5762 |
|
Research Area: I
|
|
K. Grohe, E. Nimerovsky, H. Singh, S. K. Vasa, B. Soeldner, B. Voegeli, C. M. Rienstra, R. Linser |
Exact distance measurements for structure and dynamics in solid proteins by fast-magic-angle-spinning NMR |
Chem. Commun. 55 (2019) 7899-7902 |
|
Research Area: I
|
|
P. Rovo, C. A. Smith, D. Gauto, B. L. de Groot, P. Schanda, R. Linser |
Mechanistic Insights into Microsecond Time-Scale Motion of Solid Proteins Using Complementary 15N and 1 H Relaxation Dispersion Techniques |
J. Am. Chem. Soc. 141 (2019) 858-869 |
|
Research Area: I
|
|
H. Singh, S. K. Vasa, H. Jangra, P. Rovo, C. Paeslack, C. K. Das, H. Zipse, L. V. Schaefer, R. Linser |
Fast Microsecond Dynamics of the Protein-Water Network in the Active Site of Human Carbonic Anhydrase II Studied by Solid-State NMR Spectroscopy |
J. Am. Chem. Soc. 141 (2019) 19276-19288 |
|
Research Area: I
|
|
D. Hoefler, R. Goddard, N. Noethling, B. List |
A Dendralenic C-H Acid |
Synlett 30 (2019) 433-436 |
|
Research Area: II
|
|
H. Kim, G. Gerosa, J. Aronow, P. Kasaplar, J. Ouyang, J. B. Lingnau, P. Guerry, C. Fares, B. List |
A multi-substrate screening approach for the identification of a broadly applicable Diels-Alder catalyst |
Nat. Commun. 10 (2019) 770 |
|
Research Area: II
|
|
F. Mandrelli, A. Blond, T. James, H. Kim, B. List |
Deracemizing alpha-Branched Carboxylic Acids by Catalytic Asymmetric Protonation of Bis-Silyl Ketene Acetals with Water or Methanol |
Angew. Chem. Int. Ed. 58 (2019) 11479-11482 |
|
Research Area: II
|
|
A. Nalepa, K. Moebius, M. Plato, W. Lubitz, A. Savitsky |
Nitroxide Spin Labels-Magnetic Parameters and Hydrogen-Bond Formation: A High-Field EPR and EDNMR Study |
Appl. Magn. Reson. 50 (2019) 1-16 |
|
Research Area: I
|
|
P. Rodriguez-Macia, L. Kertess, J. Burnik, J. A. Birrell, E. Hofmann, W. Lubitz, T. Happe, O. Ruediger |
His-Ligation to the [4Fe-4S] Subcluster Tunes the Catalytic Bias of [FeFe] Hydrogenase |
J. Am. Chem. Soc. 141 (2019) 472-481 |
|
Research Area: II
|
|
J. M. Schuller, J. A. Birrell, H. Tanaka, T. Konuma, H. Wulfhorst, N. Cox, S. K. Schuller, J. Thiemann, W. Lubitz, P. Setif, T. Ikegami, B. D. Engel, G. Kurisu, M. M. Nowaczyk |
Structural adaptions of photosynthetic complex I enable ferredoxin-dependent electron transfer |
Science 363 (2019) 257-260 |
|
Research Area: II
|
|
Y. Kutin, N. Cox, W. Lubitz, A. Schnegg, O. Ruediger |
In Situ EPR Characterization of a Cobalt Oxide Water Oxidation Catalyst at Neutral pH |
Catalysts 9 (2019) 926 |
|
Research Area: I
|
|
M. Loipersberger, J. Lee, Y. Mao, A. K. Das, K. Ikeda, J. Thirman, T. Head-Gordon, M. Head-Gordon |
Energy Decomposition Analysis for Interactions of Radicals: Theory and Implementation at the MP2 Level with Application to Hydration of Halogenated Benzene Cations and Complexes between CO2- Radical and Pyridine and Imidazole |
J. Phys. Chem. A 123 (2019) 9621-9633 |
|
Research Area: II
|
|
R. Tripathi, J. Noetzel, D. Marx |
Exposing catalytic versatility of GTPases: taking reaction detours in mutants of hGBP1 enzyme without additional energetic cost |
Phys. Chem. Chem. Phys. 21 (2019) 859-867 |
|
Research Area: II
|
|
N. Kumar, D. Marx |
How do ribozymes accomodate additional water molecules upon hydrostatic compression deep into the kilobar pressure regime? |
Biophys. Chem. 252 (2019) 106192 |
|
Research Area: III
|
|
M. F. Pill, A. L. L. East, D. Marx, M. K. Beyer, H. Clausen-Schaumann |
Mechanical Activation Drastically Accelerates Amide Bond Hydrolysis, Matching Enzyme Activity |
Angew. Chem. Int. Ed. 58 (2019) 9787-9790 |
|
Research Area: III
|
|
S. Ruiz-Barragan, D. Munoz-Santiburcio, D. Marx |
Nanoconfined Water within Graphene Slit Pores Adopts Distinct Confinement-Dependent Regimes |
J. Phys. Chem. Lett. 10 (2019) 329-334 |
|
Research Area: III
|
|
S. Imoto, D. Marx |
Pressure Response of the THz Spectrum of Bulk Liquid Water Revealed by Intermolecular Instantaneous Normal Mode Analysis |
J. Chem. Phys. 150 (2019) 84502 |
|
Research Area: III
|
|
F. Uhl, D. Marx |
Quantum Microsolvation of Protonated Methane with 4He: Large-Amplitude Motion Heavily Influences Bosonic Exchange |
Phys. Rev. Lett. 123 (2019) 123002 |
|
Research Area: III
|
|
C. Schran, D. Marx |
Quantum nature of the hydrogen bond from ambient conditions down to ultra-low temperatures |
Phys. Chem. Chem. Phys. 21 (2019) 24967-24975 |
|
Research Area: III
|
|
J. Daru, P. K. Gupta, D. Marx |
Restricting Solvation in Two Dimensions: Soft Landing of Microsolvated Ions in Inert Surfaces |
Phys. Chem. Lett. 10 (2019) 831-835 |
|
Research Area: I
|
|
R. Tripathi, H. Forbert, D. Marx |
Settling the Long-Standing Debate on the Proton Storage Site of the Prototype Light-Driven Proton Pump Bacteriorhodopsin |
J. Phys. Chem. B 123 (2019) 9598-9608 |
|
Research Area: II
|
|
P. K. Gupta, P. Schienbein, J. Daru, D. Marx |
Terahertz Spectra of Microsolvated Ions: Do they Reveal Bulk Solvation Properties? |
J. Phys. Chem. Lett. 10 (2019) 393-398 |
|
Research Area: I
|
|
P. K. Gupta, A. Esser, H. Forbert, D. Marx |
Toward theoretical terahertz spectroscopy of glassy aqueous solutions: partially frozen solute-solvent couplings of glycine in water |
Phys. Chem. Chem. Phys. 9 (2019) 4975-4987 |
|
Research Area: I
|
|
S. Amirjalayer, H. Fuchs, D. Marx |
Understanding the Mechanocatalytic Conversion of Biomass: A Low-Energy One-Step Reaction Mechanism by Applying Mechanical Force |
Angew. Chem. Int. Ed. 58 (2019) 5232-5235 |
|
Research Area: III
|
|
H. Vondracek, S. Imoto, L. Knake, G. Schwaab, D. Marx, M. Havenith |
Hydrogen-Bonding in Liquid Water at Multikilobar Pressures |
J. Phys. Chem. B 123 (2019) 7748-7753 |
|
Research Area: III
|
|
C. Hoelzl, P. Kibies, J. Noetzel, M. Knierbein, P. Salmen, M. Paulus, J. Nase, C. Held, G. Sadowski, D. Marx, S. M. Kast, D. Horinek |
Structure and thermodynamics of aqueous urea solutions from ambient to kilobar pressures: From thermodynamic modeling, experiments, and first principles simulations to an accurate force field description |
Biophys. Chem. 254 (2019) 106260 |
|
Research Area: III
|
|
S.-H. Yoo, N. Siemer, M. Todorova, D. Marx, J. Neugebauer |
Deciphering Charge Transfer and Electronic Polarization Effects at Gold Nanocatalysts on Reduced Titania Support |
J. Phys. Chem. C 123 (2019) 5495-5506 |
|
Research Area: II
|
|
C. Merten, T. P. Golub, N. M. Kreienborg |
Absolute Configurations of Synthetic Molecular Scaddolds from Vibrational CD Spectroscopy |
J. Org. Chem. 84 (2019) 8797-8814 |
|
Research Area: II
|
|
H. Li, R. Gontla, J. Flegel, C. Merten, S. Ziegler, A. P. Antonchick, H. Waldmann |
Enantioselective Formal C(sp3)-H Bond Activation in the Synthesis of Bioactive Spiropyrazolone Derivatives |
Angew. Chem. Int. Ed. 58 (2019) 307-311 |
|
Research Area: A
|
|
M.-L. Delcourt, S. Felder, S. Turcaud, C. H. Pollok, C. Merten, L. Micouin, E. Benedetti |
Highly Enantioselective Asymmetric Transfer Hydrogenation: A Practical and Scalable Method To Effieciently Access Planar Chiral [2.2]Paracyclophanes |
J. Org. Chem. 84 (2019) 5369-5382 |
|
Research Area: II
|
|
N. M. Kreienborg, C. Merten |
How to treat C-F stretching vibrations? A vibrational CD study on chiral fluorinated molecules |
Phys. Chem. Chem. Phys. 21 (2019) 3506-3511 |
|
Research Area: II
|
|
M. Leverenz, C. Merten, A. Dreuw, T. Bach |
Lewis Acid Catalyzed Enantioselective Photochemical Rearrangements on the Singlet Potential Energy Surface |
J. Am. Chem. Soc. 141 (2019) 20053-20057 |
|
Research Area: II
|
|
L. Weirich, C. Merten |
Solvation and self-aggregation of chiral alcohols: how hydrogen bonding affects their VCD spectral signatures |
Phys. Chem. Chem. Phys. 21 (2019) 13494-13503 |
|
Research Area: II
|
|
N. M. Kreienborg, J. Bloino, T. Osowski, C. H. Pollok, C. Merten |
The vibrational CD spectra of propylene oxide in liquid xenon: a proof-of-principle CryoVCD study that challenges theory |
Phys. Chem. Chem. Phys. 21 (2019) 6582-6587 |
|
Research Area: III
|
|
I. Weber, N. Gerrard, A. Hodgson, K. Morgenstern |
Structural Changes to Supported Water Nanoislands Induced by Kosmotropic Ions |
J. Phys. Chem. C 123 (2019) 6861-6868 |
|
Research Area: I
|
|
C. Bertram, W. Fang, P. Pedevilla, A. Michaelides, K. Morgenstern |
Anomalously Low Barrier for Water Dimer Diffusion on Cu(111) |
Nano Lett. 19 (2019) 3049-3056 |
|
Research Area: I
|
|
M. Garcia-Rates, F. Neese |
Efficient implementation of the analytical second derivatives of hatree-fock and hybrid DFT energies within the framework of the conductor-like polarizable continuum model |
J. Comput. Chem. 40 (2019) 1816-1828 |
|
Research Area: II
|
|
A. Sirohiwal, F. Neese, D. A. Pantazis |
Microsolvation of the Redox-Active Tyrosine-D in Photosystem II: Correlation of Energetics with EPR Spectroscopy and Oxidation-Induced Proton Transfer |
J. Am. Chem. Soc. 141 (2019) 3217-3231 |
|
Research Area: I
|
|
R. Ghafarian Shirazi, F. Neese, D. A. Pantazis, G. Bistoni |
Physical Nature of Differential Spin-State Stabilization of Carbenes by Hydrogen and Halogen Bonding: A Domain-Based Pair Natural Orbital Coupled Cluster Study |
J. Phys. Chem. A 123 (2019) 5081-5090 |
|
Research Area: II
|
|
M. Chrysina, E. Heyno, Y. Kutin, M. Reus, H. Nilsson, M. N. Nowaczyk, S. DeBeer, F. Neese, J. Messinger, W. Lubitz, N. Cox |
Five-coordinate Mn(IV) intermediate in the activation of nature's water splitting cofactor |
Proc. Natl. Acad. Sci. U.S.A. 116 (2019) 16841-16846 |
|
Research Area: II
|
|
B. A. Erickson, Z. N. Heim, E. Pieri, E. Liu, T. J. Martinez, D. M. Neumark |
Relaxation Dynamics of Hydrated Thymine, Thymidine, and Thymidine Monophosphate Probed by Liquid Jet Time-Resolved Photoelectron Spectroscopy |
J. Phys. Chem. A 123 (2019) 10676-10684 |
|
Research Area: I
|
|
D. Buesen, T. Hoefer, H. Zhang, N. Plumere |
A kinetic model for redox-active film based biophotoelectrodes |
Faraday Discuss. 215 (2019) 39-53 |
|
Research Area: III
|
|
H. Li, D. Buesen, S. Dementin, C. Leger, V. Fourmond, N. Plumere |
Complete Protection of O2-Sensitive Catalysts in Thin Films |
J. Am. Chem. Soc. 141 (2019) 16734-16742 |
|
Research Area: III
|
|
Y.-W. Choi, F. Scholten, I. Sinev, B. Roldan Cuenya |
Enhanced Stability and CO/Formate Selectivity of Plasma-Treated SnOx/AgOx Catalysts during CO2 Electroreduction |
J. Am. Chem. Soc. 141 (2019) 5261-5266 |
|
Research Area: II
|
|
I. Zegkinoglou, L. Pielsticker, Z.-K. Han, N. Divins, D. Kordus, Y.-T. Chen, C. Escudero, V. Perez-Dieste, B. Zhu, Y. Gao, B. Roldan Cuenya |
Surface Segregation in CuNi Nanoparticle Catalysts During CO2 Hydrogenation: The Role of CO in the Reactant Mixture |
J. Phys. Chem. C 123 (2019) 8421-8428 |
|
Research Area: II
|
|
K. Wysoczanska, G. Sadowski, E. A. Macedo, C. Held |
Toward Thermodynamic Predictions of Aqueous Vitamin Solubility: An Activity Coefficient-Based Approach |
Ind. Eng. Chem. Res. 58 (2019) 7362-7369 |
|
Research Area: I
|
|
A. Samarov, I. Prikhodko, N. Shner, G. Sadowski, C. Held, A. Toikka |
Liquid-liquid Equilibria for Separation of Alcohols from Esters Using Deep Eutectic Solvents Based on Choline Chloride: Experimental Study and Thermodynamic Modeling |
J. Chem. Eng. Data 64 (2019) 6049-6059 |
|
Research Area: III
|
|
A. Wangler, R. Loll, T. Greinert, G. Sadowski, C. Held |
Predicting the high concentration co-solvent influence on the reaction equilibria of the ADH-catalyzed reduction of acetophenone |
J. Chem. Thermodyn. 128 (2019) 275-282 |
|
Research Area: II
|
|
A. Wangler, A. Hueser, G. Sadowski, C. Held |
Simultaneous Predicition of Cosolvent Influence on Reaction Equilibrium and Michaelis Constants of Enzyme-Catalyzed Ketone Reductions |
ACS Omega 4 (2019) 6264-6272 |
|
Research Area: I
|
|
K. Wysoczanska, E. A. Macedo, G. Sadowski, C. Held |
Solubility Enhancement of Vitamins in Water in the Presence of Covitamins: Measurements and ePC-SAFT Predictions |
Ind. Eng. Chem. Res. 58 (2019) 21761-21771 |
|
Research Area: II
|
|
J. Brinkmann, F. Huxoll, C. Luebbert, G. Sadowski |
Solubility of pharmaceutical ingredients in triglycerides |
Eur. J. Pharm. Biopharm. 145 (2019) 113-120 |
|
Research Area: II
|
|
A. Wangler, C. Held, G. Sadowski |
Thermodynamic Activity-Based Solvent Design for Bioreactions |
Trends Biotechnol. 37 (2019) 1038-1041 |
|
Research Area: II
|
|
M. Knierbein, A. Wangler, Q. L. Trung, R. Winter, C. Held, G. Sadowski |
Combined co-solvent and pressure effect on kinetics of a peptide hydrolysis: an activity-based approach |
Phys. Chem. Chem. Phys. 21 (2019) 22224-22229 |
|
Research Area: III
|
|
C. Held, T. Stolzke, M. Knierbein, M. W. Jaworek. T. Q. Luong, R. Winter, G. Sadowski |
Cosolvent and pressure effects on enzyme-catalysed hydrolysis reactions |
Biophys. Chem. 252 (2019) 106209 |
|
Research Area: III
|
|
J. Bongard, A. L. Schmitz, A. Wolf, G. Zischinsky, M. Pieren, B. Schellhorn, K. Bravo-Rodriguez, J. Schillinger, U. Koch, P. Nussbaumer, B. Klebl, J. Steinmann, J. Buer, E. Sanchez-Garcia, M. Ehrmann, M. Kaiser |
Chemical validation of DegS as a target for development of antibiotics with a novel mode of action |
ChemMedChem 14 (2019) 1074-1078 |
|
Research Area: II
|
|
N. Smith, M. P. Rodero, N. Bekaddour, V. Bondet, Y. B. Ruiz-Blanco, M. Harms, B. Mayer, B. Bader-Meunier, P. Quartier, C. Bodemer, V. Baudouin, Y. Dieudonne, F. Kirchhoff, E. Sanchez-Garcia, B. Charbit, N. Leboulanger, B. Jahrsdoerfer, Y. Richard, A.-S. Korganow, J. Muench, S. Nisole, D. Duffy, J.-P. Herbeuval |
Control of TLR7-mediated type I IFN signaling in pDCs through CXCR4 engagement - A new target for lupus treatment |
Sci. Adv. 5 (2019) aav9019 |
|
Research Area: II
|
|
J. Xu, J. Mieres-Perez, E. Sanchez-Garcia, J. K. Lee |
Gas-Phase Deprotonation of Benzhydryl Cations: Carbene Basicity, Multiplicity, and Rearrangements |
J. Org. Chem. 84 (2019) 7685-7693 |
|
Research Area: II
|
|
L. Bartsch, M. Bartel, A. Gigante, J. Iglesias-Fernandez, Y. B. Ruiz-Blanco, C. Beuck, J. Briels, N. Toetsch, P. Beyer, E. Sanchez-Garcia, C. Ottmann, C. Schmuck |
Multivalent ligands with tailor-made anion binding motif as stabilizer of protein-protein interactions |
ChemBioChem 20 (2019) 2921-2926 |
|
Research Area: II
|
|
S. Romero-Molina, Y. B. Ruiz-Blanco, M. Harms, J. Muench, E. Sanchez-Garcia |
PPI-Detect: A support vector machine model for sequence-based predicition of protein-protein interactions |
J. Comput. Chem. 40 (2019) 1233-1242 |
|
Research Area: II
|
|
S. Romero-Molina, Y. B. Ruiz-Blanco, J. R. Green, E. Sanchez-Garcia |
ProtDCal-Suite: A web server for the numerical codification and functional analysis of proteins |
Protein Sci. 28 (2019) 1734-1743 |
|
Research Area: II
|
|
N. Berger, L. J. B. Wollny, P. Sokkar, S. Mittal, J. Mieres-Perez, R. Stoll, W. Sander, E. Sanchez-Garcia |
Solvent-Enhanced Conformational Flexibility of Cyclic Tetrapeptides |
ChemPhysChem 20 (2019) 1664-1670 |
|
Research Area: II
|
|
J. Knorr, P. Sokkar, P. Costa, W. Sander, E. Sanchez-Garcia, P. Nuernberger |
How Protic Solvents Determine the Reaction Mechanisms of Diphenylcarbene in Solution |
J. Org. Chem. 84 (2019) 11450-11457 |
|
Research Area: II
|
|
I. Trosien, E. Medez-Vega, T. Thomanek, W. Sander |
Conformational Spin Switching and Spin-Selective Hydrognation of a Magnetically Bistable Carbene |
Angew. Chem. Int. Ed. 58 (2019) 14866-14859 |
|
Research Area: II
|
|
E. Mendez-Vega, J. Mieres-Perez, S. V. Chapyshev, W. Sander |
Persistent Organic High-Spin Trinitrenes |
Angew. Chem. Int. Ed. 58 (2019) 12994-12998 |
|
Research Area: II
|
|
T. Schleif, J. Mieres-Perez, S. Henkel, E. Mendez-Vega, H. Inui, R. J. McMahon, W. Sander |
Conformer-Specific Heavy-Atom Tunneling in the Rearrangement of Benzazirines to Ketenimines |
J. Org. Chem. 84 (2019) 16013-16018 |
|
Research Area: III
|
|
C.-L. Tsai, F. Meyer, A. Omar, Y. Wang, A.-Y. Liang, C.-H. Lu, M. Hoffmann, S.-D. Yang, C. J. Saraceno |
Efficient nonlinear compression of a mode-locked thin-disk oscillator to 27 fs at 98 W average power |
Opt. Lett. 44 (2019) 4115-4118 |
|
Research Area: III
|
|
F. Meyer, N. Hekmat, T. Vogel, A. Omar, S. Mansourzadeh, F. Fobbe, M. Hoffmann, Y. Wang, C. J. Saraceno |
Milliwatt-class broadband THz source driven by a 112 W, sub-100 fs thin-disk laser |
Opt. Express 27 (2019) 30340-30349 |
|
Research Area: III
|
|
C. J. Saraceno, D. Sutter, T. Metzger, M. Abdou Ahmed |
The amazing progress of high-power ultrafast thin-disk lasers |
J. Eur. Opt. Soc.-Rapid Publ. 15 (2019) 15 |
|
Research Area: I
|
|
W. T. S. Cole, H. Wei, S. C. Nguyen, C. B. Harris, D. J. Miller, R. J. Saykally |
Dynamics of Micropollutant Adsorption to Polystyrene Surfaces Probed by Angle-Resolved Second Harmonic Scattering |
J. Phys. Chem. C 123 (2019) 14362-14369 |
|
Research Area: I
|
|
S. Wingbermuehle, L. V. Schaefer |
On Obtaining Boltzmann-Distributed Configurational Ensembles from Expanded Ensemble Simulations with Fast State Mixing |
J. Chem. Theory Comput. 15 (2019) 2274-2779 |
|
Research Area: I
|
|
C. Paeslack, L. V. Schaefer, M. Heyden |
Atomistic charcterization of collective protein-water-membrane dynamics |
Phys. Chem. Chem. Phys. 21 (2019) 15958-15965 |
|
Research Area: I
|
|
C. Paeslack, J. C. Smith, M. Heyden, L. V. Schaefer |
Hydration-mediated stiffening of collective membrane dynamics by cholesterol |
Phys. Chem. Chem. Phys. 21 (2019) 10370-10376 |
|
Research Area: I
|
|
M. Blech, S. Hoerer, A. B. Kuhn, S. Kube, H. Goeddeke, H. Kiefer, Y. Zang, Y. Alber, S. M. Kast, M. Westermann, M. D. Tully, L. V. Schaefer, P. Garidel |
Structure of a Therapeutic Full-Length Anti-NPRA IgG4 Antibody: Dissecting Conformation Diversity |
Biophys. J. 116 (2019) 1637-1649 |
|
Research Area: II
|
|
S. Siwaipram, P. Bopp, J.-C. Soetens, R. Schmid, S. Bureekaew |
Development of a MOF-FF-compatible interaction model for liquid methanol and Cl- in methanol |
J. Mol. Liq. 285 (2019) 526-534 |
|
Research Area: II
|
|
A. C. Medina, R. Schmid |
High Order Compact Multigrid Solver for Implicit Solvation Models |
J. Chem. Theory Comput. 15 (2019) 1293-1301 |
|
Research Area: I
|
|
A. C. Medina, R. Schmid |
Solution of high order compact discretized 3D elliptic partial differential equations by an accelerated multigrid method |
J. Comput. Appl. Math. 350 (2019) 343-352 |
|
Research Area: I
|
|
F. Zhao, P. Wang, A. Ruff, V. Hartmann, S. Zacarias, I. A. C. Pereira, M. M. Nowaczyk, M. Roegner, F. Conzuelo, W. Schuhmann |
A photosystem I monolayer with anisotropic electron flow enables Z-scheme like photosynthetic water splitting |
Energy Environ. Sci. 12 (2019) 3133-3143 |
|
Research Area: II
|
|
M. Riedel, J. Wersig, A. Ruff, W. Schuhmann, A. Zouni, F. Lisdat |
A Z-Scheme-Inspired Photobioelectrochemical H2O/O2 Cell with a 1 V Open-Circuit Voltage Combining Photosystem-II and PbS Quantum Dots |
Angew. Chem. Int. Ed. 58 (2019) 801-805 |
|
Research Area: I
|
|
S. Teanphonkrang, A. Ernst, S. Janke, P. Chaiyen, J. Sucharitakul, W. Suginta, P. Khunkaewla, W. Schuhmann, A. Schulte, A. Ruff |
Amperometric Detection of the Urinary Disease Biomarker p-HPA by Allosteric Modulation of a Redox Polymer-Embedded Bacterial Reductase |
ACS Sens. 4 (2019) 1270-1278 |
|
Research Area: II
|
|
N. Markovic, F. Conzuelo, J. Szczcesny, M. B. Gonzalez-Garcia, D. Hernandez-Santos, A. Ruff, W. Schuhmann |
An Air-breathing Carbon Cloth-based Screen-printed Electrode for Applications in Enzymatic Biofuel Cells |
Electroanalysis 31 (2019) 217-221 |
|
Research Area: II
|
|
P. B. O'Mara, P. Wilde, T. M. Benedetti, C. andronescu, S. Cheong, J. J. Gooding, R. D. Tilley, W. Schuhmann |
Cascade Reactions in Nanozymes: Spatially Separated Active Sites inside Ag-Core-Porous-Cu-Shell Nanoparticles for Multistep Carbon Dioxide Reduction to Higher Organic Molecules |
J. Am. Chem. Soc. 141 (2019) 14093-14097 |
|
Research Area: II
|
|
D. Oehl, D. Franzen, M. Paulisch, S. Dieckhoefer, S. Barwe, C. Andronescu, I. Manke, T. Turek, W. Schuhmann |
Catalytic Reactivation of Industrial Oxygen Depolarized Cathodes by in situ Generation of Atomic Hydrogen |
ChemSusChem 12 (2019) 2732-2739 |
|
Research Area: II
|
|
A. Alinezhad, L. Gloag, T. M. Benedetti, S. Cheong, R. F. Webster, M. Roelsgaardm B. B. Iversen, W. Schuhmann, J. J. Gooding, R. D. Tilley |
Direct Growth of Highly Strained Pt Islands on Branched Ni Nanoparticles for Improved Hydrogen Evolution Reaction Activity |
J. Am. Chem. Soc. 141 (2019) 16202-16207 |
|
Research Area: II
|
|
C. Santana Santos, F. Conzuelo, V. Essmann, M. Bertotti, W. Schuhmann |
Enhanced sensitivity of scanning bipolar electrochemical microscopy for O2 detection |
Anal. Chim. Acta 1087 (2019) 36-43 |
|
Research Area: II
|
|
D. Wintrich, D. Oehl, S. Barwe, A. Ganassin, S. Moeller, T. Tarnev, A. Botz, A. Ruff, J. Clausmeyer, J. Masa, W. Schuhmann |
Enhancing the Selectivity between Oxygen and Chlorine towards Anodic Chlorine Evolution Reaction on a Dimensionally Stable Anode |
ChemElectroChem 6 (2019) 3108-3112 |
|
Research Area: II
|
|
B. Gleede, T. Yamamoto, K. Nakahara, A. Botz, T. Grassl, R. Neuber, T. Matthee, Y. Einaga, W. Schuhmann, S. R. Waldvogel |
Influence of the Nature of Boron-Doped Diamond Anodes on the Dehydrogenative Phenol-Phenol Cross-Coupling |
ChemElectroChem 6 (2019) 2271-2776 |
|
Research Area: II
|
|
S. Alsaoub, F. Conzuelo, S. Gounel, N. Mano, W. Schuhmann, A. Ruff |
Introducing Pseudocapacitive Bioelectrodes into a Biofuel Cell/Biosupercapacitor Hybrid Device for Optimized Open Circuit Voltage |
ChemElectroChem 6 (2019) 2080-2087 |
|
Research Area: II
|
|
F. Mariani, F. Conzuelo, T. Cramer, I. Gualandi, L. Possanzini, M. Tessarolo, B. Fraboni, W. Schuhmann, E. Scavetta |
Microscopic Determination of Carrier Density and Mobility in Working Organic Electrochemical Transistors |
Small 15 (2019) 1902534 |
|
Research Area: II
|
|
F. Madzharova, D. Oehl, J. Junqueira, W. Schuhmann, J. Kneipp |
Plasmon Enhanced Two-Photon Probing with Gold and Silber Nanovoid Structures |
Adv. Opt. Mat. 7 (2019) 1900650 |
|
Research Area: II
|
|
T. Tarnev, H. B. Aiyappa, A. Botz, T. Erichsen, A. Ernst, C. Andronescu, W. Schuhmann |
Scanning Electrochemical Cell Microscopy Investigation of Single ZIF-Derived Nanocomposite Particles as Electrocatalysts for Oxygen Evolution in Alkaline Media / Elektrochemische Rasterzellmikroskopie einzelner ZIF-basierter Nanokompositpartikel als Elektrokatalysatoren fuer die Sauerstoffentwicklung in alkalischen Medien |
Angew. Chem. Int. Ed. 58 (2019) 14265-14269 |
|
Research Area: I
|
|
J. Masa, W. Schuhmann |
The Role of Non-Metallic and Metalloid Elements on the Electrocatalytic Activity of Cobalt and Nickel Catalysts for the Oxygen Evolution Reaction |
ChemCatChem 11 (2019) 5842-5854 |
|
Research Area: II
|
|
A. Ruff, S. Janke, J. Szczesny, S. Alsaoub, I. Ruff, W. Lubitz, W. Schuhmann |
Polymer-Bound DuBois-Type Molecular H2 Oxidation Ni Catalysts Are Protected by Redox Polymer Matrices |
ACS Appl. Energy Mater. 2 (2019) 2921-2929 |
|
Research Area: III
|
|
S. Cychy, D. Hiltrop, C. Andronescu, M. Muhler, W. Schuhmann |
Operando Thin-Layer ATR-FTIR Spectroelectrochemical Radial Flow Cell with Tilt Correction and Borehole Electrode |
Anal. Chem. 91 (2019) 14323-14331 |
|
Research Area: II
|
|
H. B. Aiyappa, P. Wilde, T. Quast, J. Masa, C. Andronescu, Y.-T. Chen, M. Muhler, R. A. Fischer, W. Schuhmann |
Oxygen Evolution Electrocatalysis of a Single MOF-Derived Composite Nanoparticle on the Tip of a Nanoelectrode / Sauerstoffevolutionselektrokatalyse eines einzelnen MOF-basierten Kompositnanopartikels an der Spitze einer Nanoelektrode |
Angew. Chem. Int. Ed. 58 (2019) 8927-8931 |
|
Research Area: I
|
|
F. Zhao, T. Bobrowski, A. Ruff, V. Hartmann, M. M. Nowaczyk, M. Roegner, F. Conzuelo, W. Schuhmann |
A light-driven Nernstian biosupercapacitor |
Electrochim. Acta 306 (2019) 660-666 |
|
Research Area: II
|
|
F. Zhao, A. Ruff, M. Roegner, W. Schuhmann, F. Conzuelo |
Extended Operational Lifetime of A Photosystem-Based Bioelectrode |
J. Am. Chem. Soc. 141 (2019) 5102-5106 |
|
Research Area: II
|
|
M. Grote, S. Kushnir, N. Pryk, D. Moeller, J. Erver, A. Ismail-Ali, F. Schulz |
Identification of crucial bottlenecks in engineered polyketide biosynthesis |
Org. Biomol. Chem. 17 (2019) 6374-6385 |
|
Research Area: II
|
|
S. Kenmoe, O. Lisovski, S. Piskunov, D. Bocharov, Y F. Zhukovskii, E. Spohr |
Electronic and optical properties of pristine, N- and S-doped water-covered TiO2 nanotube surfaces |
J. Chem. Phys. 150 (2019) 041714 |
|
Research Area: I
|
|
S. Piskunov, O. Lisovski, J. Begens, D. Bocharov, Y. F. Zhukovskii, M. Wessel, E. Spohr |
First-Principles Evaluation of the Morphology of WS2 Nanotubes for Application as Visible-Light-Driven Water-Splitting Photocatalysts |
ACS Omega 4 (2019) 1434-1443 |
|
Research Area: I
|
|
S. Kenmoe, E. Sphor |
Photooxidation of Water on Pristine, S- and N-Doped TiO2(001) Nanotube Surfaces: A DFT plus U Study |
J. Phys. Chem. C 123 (2019) 22691-22698 |
|
Research Area: II
|
|
C. Weis, G. Spiekermann, C. Sternemann, M. Harder, G. Vanko, V. Cerantola, C. J. Sahle, Y. Forov, R. Sakrowski, I. Kupenko, S. Petitgirard, H. Yavas, C. Bressler, W. Gawelda, M. Tolan, M. Wilke |
Combining X-ray Kbeta1,3, valence-to-core, and X-ray Raman spectroscopy for studying Earth materials at high pressure and temperature: the case of siderite |
J. Anal. At. Spectrom. 34 (2019) 384-393 |
|
Research Area: III
|
|
S. Demand, S. Egger, P. Degen, P. Salmen, M. Paulus, M. Tolan, H. Rehage |
New Approach to Structure-Property Correlations of Different Films of Sorbitan Esters and Their Self-Assembly into Viscoelastic Monolayers |
J. Surfactants Deterg. 20 (2019) 597-611 |
|
Research Area: III
|
|
P. Degen, M. Paulus, E. Zwar, V. Jakobi, S. Dogan, M. Tolan, H. Rehage |
Surfactant-mediated formation of alginate layers at the water-air interface |
Surf. Interface Anal. 51 (2019) 1051-1058 |
|
Research Area: III
|
|
K. Julius, J. Weine, M. Gao, J. Latarius, M. Elbers, M. Paulus, M. Tolan, R. Winter |
Impact of macromolecular crowding and compression on protein-protein interactions and liquid-liquid phase separation phenomena |
Macromolecules 52 (2019) 1772-1784 |
|
Research Area: III
|
|
A. El Arrasi, Z. Liu, M. Evers, N. Blanc, G. Bendt, S. Saddeler, D. Tetzlaff, D. Pohl, C. Damm, S. Schulz, K. Tschulik |
Intrinsic Activity of Oxygen Evolution Catalysts Probed at Single CoFe2O4 Nanoparticles |
J. Am. Chem. Soc. 141 (2019) 9197-9201 |
|
Research Area: I
|
|
M. V. Evers, M. Bernal, B. Roldan Cuenya, K. Tschulik |
Piece by Piece - Electrochemical Synthesis of Individual Nanoparticles and their Performance in ORR Electrocatalysis / Partikel fuer Partikel - Elektrochemische Einschlagsexperimente zur Synthese oberflaechenimmobilisierter Goldnanopartikel fuer die Elektrokatalyse |
Angew. Chem. Int. Ed. 58 (2019) 8221-8225 |
|
Research Area: I
|
|
K. Wonner, M. V. Evers, K. Tschulik |
The electrochemical dissolution of single nanoparticles enlightened by hyperspectral dark-field microscopy |
Electrochim. Acta 301 (2019) 458-464 |
|
Research Area: I
|
|
T. Loeffler, J. Clausmeyer, P. Wilde, K. Tschulik, W. Schuhmann, E. Ventosa |
Single entity electrochemistry for the elucidation of lithiation kinetics of TiO2 particles in non-aqueous batteries |
Nano Energy 57 (2019) 827-834 |
|
Research Area: I
|
|
G. Moon, M. Yu, C. K. Chan, H. Tueysuez |
Highly Active Cobalt-Based Electrocatalysts with Facile Incorporation of Dopants for the Oxygen Evolution Reaction |
Angew. Chem. Int. Ed. 58 (2019) 3491-3495 |
|
Research Area: II
|
|
F. Geppert, D. Liu, E. Weidner, A. ter Heijne |
Redox-flow battery design for a methane-producing bioelectrochemical system |
Int. J. Hydrog. Energy 44 (2019) 21464-21469 |
|
Research Area: I
|
|
Z. Xia, E. R. Williams |
Effect of Droplet Lifetime on Where Ions are Formed in Electrospray Ionization |
Analyst 144 (2019) 237-248 |
|
Research Area: I
|
|
E. M. van Well, V. Bader, M. Patra, A. Sanchez-Vincente, J. Meschede, N. Furthmann, C. Schnack, A. Blusch, J. Longworth, E. Petrasch-Parwez, K. Mori, T. Arzberger, D. Truembach, L. Angersbach, C. Showkat, D. A. Sehr, L. A. Berlemann, P. Goldmann, A. M. Clement, C. Behl, A. C. Woerner, C. Saft, W. Wurst, C. Haass, G. Ellrichmann, R. Gold, G. Dittman, M. S. Hipp, F. U. Hartl, J. Tatzelt, K. F. Winklhofer |
A protein quality control pathway regulated by linear ubiquitination |
EMBO J. 38 (2019) e100730 |
|
Research Area: I
|
|
A. Levin, S. Cinar, M. Paulus, J. Nase, R. Winter, C. Czeslik |
Analyzing Protein-Ligand and Protein-Interface Interactions Using High Pressure |
Biophys. Chem. 252 (2019) 106194 |
|
Research Area: III
|
|
P. H. Schummel, C. Anders, M. W. Jaworek, R. Winter |
Cosolvent and Crowding Effects on the Temperature- and Pressure-Dependent Dissociation Process of the alpha/beta-Tubulin Heterodimer |
ChemPhysChem 20 (2019) 1098-1109 |
|
Research Area: III
|
|
L. Li, N. Erwin, S. Moebitz, F. Niemeyer, T. Schrader, R. Winter |
Dissociation of the Signaling Protein K-Ras4B from Lipid Membranes Induced by a Molecular Tweezer |
Chem. Eur. J. 25 (2019) 9827-9833 |
|
Research Area: II
|
|
V. Voloshin, N. Smolin, A. Geiger, R. Winter, N. Medvedev |
Dynamics of TMAO and urea in the hydration shell of the protein SNase |
Phys. Chem. Chem. Phys. 21 (2019) 19469-19479 |
|
Research Area: III
|
|
M. Herzog, M. Dwivedi, R. K. Harishchandra, A. Bilstein, H.-J. Galla, R. Winter |
Effect of ectoine, hydroxyectoine and beta-hydroxybutyrate on the temperature and pressure stability of phospholipid bilayer membranes of different complexity |
Colloids Surf. B 178 (2019) 404-411 |
|
Research Area: III
|
|
M. Herzog, L. Li, H. J. Galla, R. Winter |
Effect of hyaluronic acid on phospholipid model membranes |
Colloids Surf. B 173 (2019) 327-334 |
|
Research Area: I
|
|
M. Manisegaran, S. Bornemann, I. Kiesel. R. Winter |
Effects of the deep-sea osmolyte TMAO on the temperature and pressure dependent structure and phase behavior of lipid membranes |
Phys. Chem. Chem. Phys. 21 (2019) 18533-18540 |
|
Research Area: III
|
|
S. Patra, V. Schuabb, I. Kiesel, J.-M. Knop, R. Oliva, R. Winter |
Exploring the effects of cosolutes and crowding on the volumetric and kinetic profile of the conformational dynamics of a poly dA loop DNA hairpin: a single-molecule FRET study |
Nucleic Acids Res. 47 (2019) 981-996 |
|
Research Area: III
|
|
S. Bornemann, M. Herzog, R. Winter |
Impact of Y3+-ions on the structure and phase behavior of phospholipid model membranes |
Phys. Chem. Chem. Phys. 21 (2019) 5730-5743 |
|
Research Area: III
|
|
R. Winter |
Interrogating the Structural Dynamics and Energetics of Biomolecular Systems with Pressure Modulation |
Annu. Rev. Biophys. 48 (2019) 441-463 |
|
Research Area: III
|
|
L. Arns, R. Winter |
Liquid-liquid phase separation rescues the conformational stability of a DNA hairpin from pressure-stress |
Chem. Commun. 55 (2019) 10673-10676 |
|
Research Area: III
|
|
R. Oliva, P. Del Vecchio, A. Grimaldi, E. Notomista, V. Cafaro, K. Pane, V. Schuabb, R. Winter, L. Petraccone |
Membrane disintegration by the antimicrobial peptide (P) GYK20: lipid segregation and domain formation |
Phys. Chem. Chem. Phys. 21 (2019) 3989-3998 |
|
Research Area: I
|
|
S. R. Al-Ayoubi, P. H. Schummel, A. Cisse, T. Seydel, J. Peters, R. Winter |
Osmolytes modify protein dynamics and function of tetrameric lactate dehydrogenase upon pressurization |
Phys. Chem. Chem. Phys. 21 (2019) 12806-12817 |
|
Research Area: III
|
|
S. Cinar, H. Cinar, H. S. Chan, R. Winter |
Pressure-Sensitive and Osmolyte-Modulated Liquid-Liquid Phase Separation of Eye-Lens gamma-Crystallins |
J. Am. Chem. Soc. 141 (2019) 7347-7354 |
|
Research Area: III
|
|
L. Arns, J.-M. Knop, S. Patra, C. Anders, R. Winter |
Single-molecule insights into the temperature and pressure dependent conformational dynamics of nucleic acids in the presence of crowders and osmolytes |
Biophys. Chem. 251 (2019) 106190 |
|
Research Area: I
|
|
H. Cinar, Z. Fetahaj, S. Cinar, R. M. Vernon, H. S. Chan, R. Winter |
Temperature, Hydrostatic Pressure, and Osmolyte Effects on Liquid-Liquid Phase Separation in Protein Condensates: Physical Chemistry and Biological Implications |
Chem. Eur. J. 25 (2019) 13049-13069 |
|
Research Area: III
|
|
M. C. Owen, D. Gnutt, M. Gao, S. K. T. S. Waermlaender, J. Jarvet, A. Graeslund, R. Winter, S. Ebbinghaus, B. Strodel |
Effects of In Vivo Conditions on Amyloid Aggregation |
Chem. Soc. Rev. 48 (2019) 3946-3996 |
|
Research Area: II
|
|
U.-P. Apfel, S. Demir, A. Berkefeld |
Trendbericht Anorganische Chemie 2017: Koordinationschemie und Bioanorganik |
Nachrichten aus der Chemie 66 (2018) 230-239 |
|
Research Area: C
|
|
J. Duan, M. Senger, J. Esselborn, V. Engelbrecht, F. Wittkamp, U.-P. Apfel, E. Hofmann, S. T. Stripp, T. Happe, M. Winkler |
Crystallographic and spectroscopic assignment of the proton transfer pathway in [FeFe]-hydrogenases |
Nat. Commun. 9 (2018) 4726 |
|
Research Area: B
|
|
J. Weidner, S. Barwe, K. Sliozberg, S. Piontek, J. Masa, U.-P. Apfel, W. Schuhmann |
Cobalt-metalloid alloys for electrochemical oxidation of 5-hydroxymethylfurfural as an alternative anode reaction in lieu of oxygen evolution during water splitting |
Beilstein J. Org. Chem. 14 (2018) 1436-1445 |
|
Research Area: C
|
|
C. L. Bentley, C. Andronescu, M. Smialkowski, M. Kang, T. Tarnev, B. Marler, P. R. Unwin, U.-P. Apfel, W. Schuhmann |
Local Surface Structure and Composition Control the Hydrogen Evolution Reaction on Iron Nickel Sulfides / Die lokale Oberflaechenstruktur und -zusammensetzung bestimmt die Wasserstoffentwicklung an Eisen-Nickelsulfiden |
Angew. Chem. Int. Ed. 57 (2018) 4093-4097 |
|
Research Area: C
|
|
G. Imbalzano, A. Anelli, D. Giofre, S. Klees, J. Behler, M. Ceriotti |
Automatic selection of atomic fingerprints and reference configurations for machine-learning potentials |
J. Chem. Phys. 148 (2018) 241730 |
|
Research Area: A
|
|
V. Quaranta, M. Hellstroem, J. Behler, J. Kullgren, P. D. Mitev, K. Hermansson |
Maximally resolved anharmonic OH vibrational spectrum of the water/ZnO(1011\0) interface from a high-dimensional neural network potential |
J. Chem. Phys. 148 (2018) 241720 |
|
Research Area: A
|
|
C. Schran, F. Uhl, J. Behler, D. Marx |
High-dimensional neural network potentials for solvation: The case of protonated water clusters in helium |
J. Chem. Phys. 148 (2018) 102310 |
|
Research Area: A
|
|
S. Bleicken, A. J. Garcia-Saez |
Bcl-2 proteins: Unraveling the details of a complex and dynamic network |
Mol. Cell. Oncol. 5 (2018) e1384880 |
|
Research Area: B
|
|
M. Teucher, E. Bordignon |
Improved signal fidelity in 4-pulse DEER with Gaussian pulses |
J. Magn. Reson. 296 (2018) 103-111 |
|
Research Area: B
|
|
T. E. Assafa, K. Anders, U. Linne, L.-O. Essen, E. Bordignon |
Light-Driven Domain Mechanics of a Minimal Phytochrome Photosensory Module Studied by EPR |
Structure 26 (2018) 1534-1545.e4 |
|
Research Area: B
|
|
E. Bordignon, S. Bleicken |
New limits of sensitivity of site-directed spin labeling electron paramagnetic resonance for membrane proteins |
Biochim. Biophys. Acta Biomembr. 1860 (2018) 841-853 |
|
Research Area: B
|
|
S. Bleicken, T. E. Assafa, C. Stegmueller, A. Wittig, A. J. Garcia-Saez, E. Bordignon |
Topology of active, membrane-embedded Bax in the context of a toroidal pore |
Cell Death Differ. 25 (2018) 1717-1731 |
|
Research Area: B
|
|
H. Goeddeke, M. H. Timachi, C. A. J. Hutter, L. Galazzo, M. A. Seeger, M. Karttunen, E. Bordignon, L. V. Schaefer |
Atomistic Mechanism of Large-Scale Conformational Transition in a Heterodimeric ABC Exporter |
J. Am. Chem. Soc. 140 (2018) 4543-4551 |
|
Research Area: B
|
|
P. Auburger, I. Kemeny, C. Bertram, M. Ligges, M. Bockstedte, U. Bovensiepen, K. Morgenstern |
Microscopic Insight into Electron-Induced Dissociation of Aromatic Molecules on Ice |
Phys. Rev. Lett. 121 (2018) 206001 |
|
Research Area: A
|
|
R. Zhu, I. Regeni, J. J. Holstein, B. Dittrich, M. Simon, S. Prevost, M. Gradzielski, G. H. Clever |
Catenation and Aggregation of Multi-Cavity Coordination Cages |
Angew. Chem. Int. Ed. 57 (2018) 13652-13656 |
|
Research Area: B
|
|
W. M. Bloch, J. J. Holstein, B. Dittrich, W. Hiller, G. H. Clever |
Hierarchical Assembly of an Interlocked M8L16 Container / Hierarchischer Aufbau eines verflochtenen M8L16-Containers |
Angew. Chem. Int. Ed. 57 (2018) 5534-5538 |
|
Research Area: A
|
|
S. Saha, B. Holzapfel, Y.-T. Chen, K. Terlinden, Pascal Lill, C. Gatsogiannis, H. Rehage, G. H. Clever |
Rational Design of an Amphiphilic Coordination Cage-Based Emulsifier |
J. Am. Chem. Soc. 140 (2018) 17284-17388 |
|
Research Area: A
|
|
E. Zwar, A. Kemna, L. Richter, P. Degen, H. Rehage |
Production, deformation and mechanical investigation of magnetic alginate capsules |
J. Phys. Condens. Matter 30 (2018) 085101 |
|
Research Area: A
|
|
R. J. Wood, A. R. Ormsby, M. Radwan, D. Cox, A. Sharma, T. Voepel, S. Ebbinghaus, M. Oliveberg, G. E. Reid, A. Dickson, D. M. Hatters |
A biosensor-based framework to measure latent proteostasis capacity |
Nat. Commun. 9 (2018) 287 |
|
Research Area: B
|
|
B. B. Majumdar, S. Ebbinghaus, M. Heyden |
Macromolecular crowding effects in flexible polymer solutions |
J. Theor. Comput. Chem. 17 (2018) 1840006 |
|
Research Area: B
|
|
F. Niu, M. Rabe, S. Nayak, A. Erbe |
Vibrational spectroscopic study of pH dependent solvation at a Ge (100)-water interface during an electrode potential triggered surface termination transition |
J. Chem. Phys. 148 (2018) 222824 |
|
Research Area: C
|
|
K.-S. Feichtner, V. H. Gessner |
Cooperative bond activation reactions with carbene complexes |
Chem. Commun. 54 (2018) 6540-6553 |
|
Research Area: A
|
|
L. T. Scharf, J. Weismann, K.-S. Feichtner, F. Lindl, V. H. Gessner |
Versatile Modes of Cooperative B-H Bond Activation Reactions in Ruthenium-Carbene Complexes: Addition, Ring-Opening and Insertion |
Chem. Eur. J. 24 (2018) 3439-3443 |
|
Research Area: A
|
|
T. Scherpf, C. Schwarz, L. T. Scharf, J.-A. Zur, A. Helbig, V. H. Gessner |
Ylide-Functionalized Phosphines: Strong Donor Ligands for Homogenous Catalysis |
Angew. Chem. Int. Ed. 57 (2018) 12859-12864 |
|
Research Area: A
|
|
X.-Q. Hu, Z. Hu, A. S. Trita, G. Zhang, L. J. Goossen |
Carboxylate-directed C-H allylation with allyl alcohols or ethers |
Chem. Sci. 9 (2018) 5289-5294 |
|
Research Area: A
|
|
X.-Q. Hu, Z. Hu, G. Zhang, N. Sivendran, L. J. Goossen |
Catalytic C-N and C-H Bond Activation: ortho-Allylation of Benzoic Acids with Allyl Amines |
Org. Lett. 20 (2018) 4337-4340 |
|
Research Area: A
|
|
S. Kovacs, B. Bayarmagnai, A. Aillerie, L. J. Goossen |
Practical Reagents and Methods for Nucleophilic and Electrophilic Phosphorothiolations |
Adv. Synth. Catal. 360 (2018) 1913-1918 |
|
Research Area: A
|
|
G. Zhang, F. Jia, L. J. Goossen |
Regioselective C-H Alkylation via Carboxylate-Directed Hydroarylation in Water |
Chem. Eur. J. 24 (2018) 4537-4541 |
|
Research Area: A
|
|
A. S. Trita, A. Biafora, M. Pichette-Drapeau, P. Weber, L. J. Goossen |
Regiospecific ortho-C-H Allylation of Benzoic Acids |
Angew. Chem. Int. Ed. 57 (2018) 14580-14584 |
|
Research Area: A
|
|
T. Wendling, E. Risto, T. Krause, L. J. Goossen |
Salt-Free Strategy for the Insertion of CO2 into C-H Bonds: Catalytic Hydroxymethylation of Alkynes |
Chem. Eur. J. 24 (2018) 6019-6024 |
|
Research Area: A
|
|
J. Pollini, V. Bragoni, L. J. Goossen |
Synthesis of a tyrosinase inhibitor by consecutive ethenolysis and cross-metathesis of crude cashew nutshell liquid |
Beilstein J. Org. Chem. 14 (2018) 2737-2744 |
|
Research Area: A
|
|
V. Bragoni, R. K. Rit, R. Kirchmann, A. S. Trita, L. J. Goossen |
Synthesis of bio-based surfactants from cashew nutshell liquid in water |
Green Chem. 20 (2018) 3210-3213 |
|
Research Area: A
|
|
D. Hayrapetyan, R. K. Rit, M. Kratz, K. Tschulik, L. J. Goossen? |
Electrochemical C-H Cyanation of Electron-Rich (Hetero)Arenes |
Chem. Eur. J. 24 (2018) 11288-11291 |
|
Research Area: A
|
|
J. R. Biller, R. Barnes, S. Han |
Perspective of Overhauser dynamic nuclear polarization for the study of soft materials |
Curr. Opin. Colloid Interface Sci. 33 (2018) 72-85 |
|
Research Area: B
|
|
A. Hemschemeier, T. Happe |
The plasticity of redox cofactors: from metalloenzymes to redox-active DNA |
Nat. Rev. Chem. 2 (2018) 231-243 |
|
Research Area: B
|
|
S. Mebs, R. Kositzki, J. F. Duan, L. Kertess, M. Senger, F. Wittkamp, U.-P. Apfel, T. Happe, S. T. Stripp, M. Winkler, M. Haumann |
Hydrogen and oxygen trapping at the H-cluster of [FeFe]-hydrogenase revealed by site-selective spectroscopy and QM/MM calculations |
Biochim. Biophys. Acta Bioenerg. 1859 (2018) 28-41 |
|
Research Area: B
|
|
M. Senger, S. Mebs, J. Duan, O. Shulenina, K. Laun, L. Kertess, F. Wittkamp, U.-P. Apfel, T. Happe, M. Winkler, M. Haumann, S. T. Stripp |
Protonation/reduction dynamics at the [4Fe-4S] cluster of the hydrogen-forming cofactor in [FeFe]-hydrogenases |
Phys. Chem. Chem. Phys. 20 (2018) 3128-3140 |
|
Research Area: B
|
|
K. Laun, S. Mebs, J. Duan, F. Wittkamp, U.-P. Apfel, T. Happe, M. Winkler, M. Haumann, S. T. Stripp |
Spectroscopical Investigations on the Redox Chemistry of [FeFe]-Hydrogenases in the Presence of Carbon Monoxide |
Molecules 23 (2018) 1669 |
|
Research Area: B
|
|
A. Marefat Khah, S. Karbalaei Khani, C. Haettig |
Analytic Excited State Gradients for the QM/MM Polarizable Embedded Second-order Algrebaic Diagrammatic Construction for the Polarization Propagator PE-ADC(2) |
J. Chem. Theory Comput. 14 (2018) 4640-4650 |
|
Research Area: A
|
|
S. Karbalaei Khani, A. Marefat Khah, C. Haettig |
COSMO-RI-ADC(2) excitation energies and excited state gradients |
Phys. Chem. Chem. Phys. 20 (2018) 16354-16363 |
|
Research Area: A
|
|
C. Klinkhammer, F. Boehm, V. Sharma, G. Schwaab, M. Seitz, M. Havenith |
Anion dependent ion pairing in concentrated ytterbium halide solutions |
J. Chem. Phys. 148 (2018) 222802 |
|
Research Area: C
|
|
K. Mukherjee, G. Schwaab, M. Havenith |
Cation-specific interactions of protein surface charges in dilute aqueous salt solutions: a combined study using dielectric relaxation spectroscopy and Raman spectroscopy |
Phys. Chem. Chem. Phys. 20 (2018) 29306-29313 |
|
Research Area: C
|
|
V. Conti Nibali, G., M. Havenith, G. D'Angelo, G. Colombo |
Concerted motions in allosteric model proteins at terahertz frequencies |
Atti Accad. Pelorit. Pericol. Cl. Fis. Mat. Nat. 96 (2018) A6 |
|
Research Area: B
|
|
H. Wirtz, S. Schaefer, C. Hoberg, M. Havenith |
Differences in Hydration Structure Around Hydrophobic and Hydrophilic Model Peptides Probed by THz Spectroscopy |
J. Infrared Millim. Terahertz Waves 39 (2018) 816-827 |
|
Research Area: A
|
|
H. Wirtz, S. Schaefer, C. Hoberg, K. M. Reid, D. M. Leitner, M. Havenith |
Hydrophobic Collapse of Ubiquitin Generates Rapid Protein-Water Motions |
Biochemistry 57 (2018) 3650-3657 |
|
Research Area: B
|
|
M. Senske, Y. Xu, A. Baeumer, S. Schaefer, H. Wirtz, J. Savolainen, H. Weingaertner, M. Havenith |
Local chemistry of the surfactant's head groups determines protein stability in reverse micelles |
Phys. Chem. Chem. Phys. 20 (2018) 8515-8522 |
|
Research Area: A
|
|
J. O. Daldrop, M. Saita, M. Heyden, V. A. Lorenz-Fonfria, J. Heberle, R. R. Netz |
Orientation of non-spherical protonated water clusters revealed by infrared absorption dichroism |
Nat. Commun. 9 (2018) 311 |
|
Research Area: B
|
|
S. Belsare, V. Pattni, M. Heyden, T. Head-Gordon |
Solvent entropy contributions to catalytic activity in designed and optimized Kemp eliminases |
J. Phys. Chem. B 122 (2018) 5300-5307 |
|
Research Area: B
|
|
M. C. Figueiredo, D. Hiltrop, R. Sundararaman, K. A. Schwarz, M. T. M. Koper |
Absence of diffuse double layer effect on the vibrational properties and oxidation of chemisorbed carbon monoxide on a Pt(111) electrode |
Electrochim. Acta 281 (2018) 127-132 |
|
Research Area: C
|
|
J. Stoesser, G. Rojas, D. Bulfield, P. I. Hidalgo, J. Pasan, C. Ruiz-Perez, C. A. Jimenez, S. M. Huber |
Halogen bonding two-point recognition with terphenyl derivatives |
New J. Chem. 42 (2018) 10476-10480 |
|
Research Area: A
|
|
F. Heinen, E. Engelage, A. Dreger, R. Weiss, S. M. Huber |
Iodine(III) derivatives as halogen bonding organocatalysts / Iod(III)-Derivate als Halogenbruecken-basierte Organokatalysatoren |
Angew. Chem. Int. Ed. 57 (2018) 3830-3833 |
|
Research Area: A
|
|
E. Engelage, N. Schulz, F. Heinen, S. M. Huber, D. Truhlar,?C. J. Cramer |
Refined SMD Parameters for Bromine and Iodine Accurately Model Halogen-Bonding Interactions in Solution |
Chem. Eur. J. 24 (2018) 15983-15987 |
|
Research Area: A
|
|
N. Schulz, S. Schindler, S. M. Huber, M. Erdelyi |
NMR Determination of the binding constant of ionic species: a caveat |
J. Org. Chem. 83 (2018) 10881-10886 |
|
Research Area: A
|
|
J. Thirman, E. Engelage, S. M. Huber, M. Head-Gordon |
Characterizing the interplay of Pauli repulsion, electrostatics, dispersion and charge transfer in halogen bonding with energy decomposition analysis |
Phys. Chem. Chem. Phys. 20 (2018) 905-915 |
|
Research Area: A
|
|
J. Thirman, E. Engelage, S. M. Huber, M. Head-Gordon |
Probing the Interplay of Pauli Repulsion, Electrostatics, Dispersion and Charge Transfer in Halogen Bonding with Energy Decomposition Analysis |
Phys. Chem. Chem. Phys. 20 (2018) 905-915 |
|
Research Area: A
|
|
J. Fassunke, F. Mueller, M. Keul, S. Michels, M. A. Dammert, A. Schmitt, D. Plenker, J. Lategahn, C. Heydt, J. Braegelmann, H. L. Tumbrink, Y. Alber, S. Klein, A. Heimsoeth, I. Dahmen, R. N. Fischer, M. Scheffler, M. A. Ihle, V. Priesner, A. H. Scheel, S. Wagener, A. Kron, K. Frank, K. Garbert, T. Persigehl, M. Puesken, S. Haneder, B. Schaaf, E. Rodermann, W. Engel-Riedel, E. Felip, E. F. Smit, S. Merkelbach-Bruse, H. C. Reinhardt, S. M.?Kast, J. Wolf, D. Rauh, R. Buettner, M. L. Sos |
Overcoming EGFRG724S-mediated osimertinib resistance through unique binding characteristics of second-generation EGFR inhibitors |
Nat. Commun. 9 (2018) 4655 |
|
Research Area: B
|
|
N. Tielker, L. Eberlein, S. Guessregen, S. M. Kast |
The SAMPL6 challenge on predicting aqueous pKa-values from EC-RISM theory |
J. Comput. Aided Mol. Des. 32 (2018) 1151-1163 |
|
Research Area: A
|
|
R. Trocoli, A. Dushina, S. Borhani-Haghighi, A. Ludwig, F. La Mantia |
Effect of Pt and Au current collector in LiMn2O4 thin film for micro-batteries |
Nanotechnology 29 (2018) 35404 |
|
Research Area: A,C
|
|
A. Klein, S. K. Vasa, R. Linser |
Automated projection spectroscopy in solid-state NMR |
J. Biomol. NMR 72 (2018) 163-170 |
|
Research Area: B
|
|
D. Hoefler, R. Goddard, J. B. Lingnau, N. Noethling, B. List |
A Purely Organic Tricarbanion / Ein rein organisches Tricarbanion |
Angew. Chem. Int. Ed. 57 (2018) 8326-8329 |
|
Research Area: A
|
|
N. Tsuji, J. L. Kennemur, T. Buyck, S. Lee, S. Prevost, P. S. J. Kaib, D. Bykov, C. Fares, B. List |
Activation of olefins via asymmetric Bronsted acid catalysis |
Science 359 (2018) 1501-1505 |
|
Research Area: A
|
|
H. Y. Bae, D. Hoefler, P. S. Kaib, P. Kasaplar, C. K. De, A. Doehring, S. Lee, K. Kaupmees, I. Leito, B. List |
Approaching sub-ppm-level asymmetric organocatalysis of a highly challenging and scalable carbon?carbon bond forming reaction |
Nat. Chem. 10 (2018) 888-894 |
|
Research Area: A
|
|
S. Lee, H. Y. Bae, B. List |
Can a Ketone Be More Reactive than an Aldehyde? Catalytic Asymmetric Synthesis of Substituted Tetrahydrofurans / Kann ein Keton reaktiver als ein Aldehyd sein? Katalytische asymmetrische Synthese von substituierten Tetrahydrofuranen |
Angew. Chem. Int. Ed. 57 (2018) 12162-12166 |
|
Research Area: A
|
|
L. Schreyer, P. S. Kaib, V. Wakchaure, C. Obradors, R. Properzi, S. Lee, B. List? |
Confined acids catalyze asymmetric single aldolizations of acetaldehyde enolates |
Science 362 (2018) 216-219 |
|
Research Area: A
|
|
J. Popovic, D. Hoefler, J.-P. Melchior, A. Muenchinger, B. List, J. Maier |
High Lithium Transference Number Electrolytes Containing Tetratriflylpropene's Lithium Salt |
J. Phys. Chem. Lett. 9 (2018) 5116-5120 |
|
Research Area: C
|
|
T. Gatzenmeier, P. S. J. Kaib, J. B. Lingnau, R. Goddard, B. List |
The Catalytic Asymmetric Mukaiyama-Michael Reaction of Silyl Ketene Acetals with alpha,beta-Unsaturated Methyl Esters / Die katalytische, asymmetrische Mukaiyama-Michael-Reaktion von Silylketenacetalen mit alpha,beta-ungesaettigten Methylestern |
Angew. Chem. Int. Ed. 57 (2018) 2464-2468 |
|
Research Area: A
|
|
H. Y. Bae, B. List |
Triflimide: An Overlooked High-Performance Catalyst of the Mukaiyama Aldol Reaction of Silyl Ketene Acetals with Ketones |
Chem. Eur. J. 24 (2018) 13767-13772 |
|
Research Area: A
|
|
T. Gatzenmeier, M. Turberg, D. Yepes, Y. Xie, F. Neese, G. Bistoni, B. List |
Scalable and Highly Diastereo- and Enantioselective Catalytic Diels-Alder Reaction of alpha,beta-Unsaturated Methyl Esters |
J. Am. Chem. Soc 140 (2018) 12671-12676 |
|
Research Area: A
|
|
P. Rodriguez-Macia, E. J. Reijerse, M. van Gastel, S. DeBeer, W. Lubitz, O. Ruediger, J. A. Birrell |
Sulfide Protects [FeFe] Hydrogenases From O2 |
J. Am. Chem. Soc. 140 (2018) 9346-9350 |
|
Research Area: B
|
|
J. Milic, M. Zalibera, D. Talaat, J. Nomrowski, N. Trapp, L. Ruhlmann, C. Boudon, O. S. Wenger, A. Savitsky, W. Lubitz, F. Diederich |
Photoredox-Switchable Resorcin[4]arene Cavitands: Radical Control of Molecular Gripping Machinery via Hydrogen Bonding |
Chem. Eur. J. 24 (2018) 1431-1440 |
|
Research Area: B
|
|
N. Siemer, A. Lueken, M. Zalibera, J. Frenzel, D. Munoz-Santiburcio, A. Savitsky, W. Lubitz, M. Muhler, D. Marx, J. Strunk |
Atomic-Scale Explanation of O2 activation at the Au-TiO2 Interface |
J. Am. Chem. Soc. 140 (2018) 18082-18092 |
|
Research Area: B
|
|
H. Li, D. Buesen, R. Williams, J. Henig, S. Stapf, K. Mukherjee, E. Freier, W. Lubitz, M. Winkler, T. Happe, N. Plumere |
Preventing the coffee-ring effect and aggregate sedimentation by in situ gelation of monodisperse materials |
Chem. Sci. 9 (2018) 7596-7605 |
|
Research Area: B
|
|
J. Szczesny, N. Markovic, F. Conzuelo, S. Zacarias, I. A. C. Pereira, W. Lubitz, N. Plumere, W. Schuhmann, A. Ruff |
A gas breathing hydrogen/air biofuel cell comprising a redox polymer/hydrogenase-based bioanode |
Nat. Commun. 9 (2018) 4715 |
|
Research Area: C
|
|
A. Ruff, J. Szczesny, N. Markovic, F. Conzuelo, S. Zacarias, I. A. C. Pereira, W. Lubitz, W. Schuhmann |
A fully protected hydrogenase/polymer-based bioanode for high-performance hydrogen/glucose biofuel cells |
Nat. Commun. 9 (2018) 3675 |
|
Research Area: C
|
|
S. Abdellatif, P. Sharifi, K. Kirah, R. Ghannam, A.S.G. Khalil, D. Erni, F. Marlow |
Refractive index and scattering of porous TiO2 films |
Microporous Mesoporous Mater. 264 (2018) 84-91 |
|
Research Area: A
|
|
S. Imoto, H. Forbert, D. Marx |
Aqueous TMAO solutions as seen by theoretical THz spectroscopy: hydrophilic versus hydrophobic water |
Phys. Chem. Chem. Phys. 20 (2018) 6146-6158 |
|
Research Area: A
|
|
C. Schran, F. Brieuc, D. Marx |
Converged Colored Noise Path Integral Molecular Dynamics Study of the Zundel Cation down to Ultralow Temperatures at Coupled Cluster Accuracy |
J. Chem. Theory Comput. 14 (2018) 5068-5078 |
|
Research Area: A
|
|
F. Uhl, D. Marx |
Helium Tagging of Protonated Methane in Messenger Spectroscopy: Does it Interfere with the Fluxionality of CH+5? |
Angew. Chem. Int. Ed. 57 (2018) 14792-14795 |
|
Research Area: A
|
|
P. Schienbein, D. Marx |
Investigation concerning the uniqueness of separatrix lines separating liquidlike from gaslike regimes deep in the supercritical phase of water with a focus on Widom line concepts |
Phys. Rev. E 98 (2018) 022104 |
|
Research Area: A
|
|
P. Schienbein, D. Marx |
Liquid-Vapor Phase Diagram of RPBE-D3 Water: Electronic Properties along the Coexistence Curve and in the Supercritical Phase |
J. Phys. Chem. B 122 (2018) 3318-3329 |
|
Research Area: A
|
|
N. Kumar, D. Marx |
Mechanistic role of nucleobases in self-cleavage catalysis of hairpin ribozyme at ambient versus high-pressure conditions |
Phys. Chem. Chem. Phys. 20 (2018) 20886-20898 |
|
Research Area: B
|
|
D. Munoz-Santiburcio, M. F. Camellone, D. Marx |
Solvation-Induced Changes in the Mechanism of Alcohol Oxidation at Gold/Titania Nanocatalysts in the Aqueous Phase versus Gas Phase |
Angew. Chem. Int. Ed. 57 (2018) 3327-3331 |
|
Research Area: C
|
|
A. Esser, H. Forbert, D. Marx |
Tagging effects on the mid-infrared spectrum of microsolvated protonated methane |
Chem. Sci. 9 (2018) 1560-1573 |
|
Research Area: A
|
|
A. Esser, H. Forbert, F. Sebastiani, G. Schwaab, M. Havenith, D. Marx |
Hydrophilic Solvation Dominates the Terahertz Fingerprint of Amino Acids in Water |
J. Phys. Chem. B 122 (2018) 1453-1459 |
|
Research Area: B
|
|
G. Shan, J. Flegel, H. Li, C. Merten, S. Ziegler, A. P. Antonchick, H. Waldmann |
C-H Bond Activation for the Synthesis of Heterocyclic Atropisomers Yields Hedgehog Pathway Inhibitors |
Angew. Chem. Int. Ed. 57 (2018) 14250-14254 |
|
Research Area: A
|
|
Y.-C. Liu, C. Merten, J. Deska |
Enantioconvergent Biocatalytic Redox Isomerization |
Angew. Chem. Int. Ed. 57 (2018) 12151-12156 |
|
Research Area: A,
|
|
K. Buennemann, C. H. Pollok, C. Merten |
Explicit Solvation of Carboxylic Acids for Vibrational Circular Dichroism Studies: Limiting the Computational Efforts without Losing Accuracy |
J. Phys. Chem. B 122 (2018) 8056-8064 |
|
Research Area: A
|
|
N. M. Kreienborg, C. Merten |
How Do Substrates Bind to Bifunctional Thiourea Catalyst? A Vibrational CD Study on Carboxylic Acid Binding |
Chem. Eur. J. 24 (2018) 17948-17954 |
|
Research Area: A
|
|
Y. Xu, A. Perera, J. Cheramy, C. Merten, J. Thomas |
IR, Raman and Vibrational Optical Activity Spectra of Methyl Glycidate in Chloroform and Water: The Clusters-in-a-Liquid Solvation Model |
ChemPhysChem 19 (2018) 2234-2242 |
|
Research Area: A
|
|
D. P. Demarque, D. R. Pinho, N. P. Lopes, C. Merten |
Revisiting empirical rules for the determination of the absolute configuration of cascarosides and other (ox-)anthrones |
Chirality 30 (2018) 432-438 |
|
Research Area: A
|
|
N. Zumbraegel, C. Merten, S. M. Huber, H. Groeger |
Enantioselective reduction of sulfur-containing cyclic imines through biocatalysis |
Nat. Commun. 9 (2018) 1949 |
|
Research Area: A
|
|
K. Lucht, D. Loose, M. Ruschmeier, V. Strotkoetter, G. Dyker, K. Morgenstern |
Hydrophilicity and Microsolvation of an Organic Molecule Resolved on the Sub-molecular Level by Scanning Tunneling Microscopy |
Angew. Chem. Int. Ed. 57 (2018) 1266-1270 |
|
Research Area: A
|
|
S.-C. Heidorn, C. Bertram, K. Morgenstern |
Low-Temperature Growth of Amorphous Water Ice on Ag(111) |
J. Phys. Chem. C 122 (2018) 15304-15310 |
|
Research Area: C
|
|
S.-C. Heidorn, K. Lucht, C. Bertram, K. Morgenstern |
Preparation-Dependent Orientation of Crystalline Ice Islands on Ag(111) |
J. Phys. Chem. B 122 (2018) 479-484 |
|
Research Area: C
|
|
C. Zaum, K. Morgenstern |
Understanding the Enhancement of Surface Diffusivity by Dimerization |
Phys. Rev. Lett. 121 (2018) 185901 |
|
Research Area: A
|
|
C. Zaum, K. Morgenstern |
Voltage dependent STM imaging of inorganic adsorbates |
Appl. Phys. Lett. 113 (2018) 31602 |
|
Research Area: C
|
|
K. Lucht, I. Trosien, W. Sander, K. Morgenstern |
Imaging the Solvation of a One-Dimensional Solid on the Molecular Scale |
Angew. Chem. Int. Ed. 57 (2018) 16334-16338 |
|
Research Area: C
|
|
S. Piontek, C. Andronescu, A. Zaichenko, B. Konkena, J. Bharathi, K. junge Puring, B. Marler, H. Antoni, I. Sinev, M. Muhler, D. Mollenhauer, B. Roldan Cuenya, W. Schuhmann, U.-P. Apfel |
Influence of the Fe:Ni Ratio and Reaction Temperature on the Efficiency of (FexNi1-x)9S8 Electrocatalysts Applied in the Hydrogen Evolution Reaction |
ACS Catal. 8 (2018) 987-996 |
|
Research Area: C
|
|
S. Barwe, J. Weidner, S. Cychy, D. M. Morales, S. Dieckhoefer, D. Hiltrop, J. Masa, M. Muhler, W. Schuhmann |
Electrocatalytic Oxidation of 5-(Hydroxymethyl)furfural Using High-Surface-Area Nickel Boride / Elektrokatalytische Oxidation von 5-(Hydroxymethyl)furfural an Nickelborid mit grosser Oberflaeche |
Angew. Chem. Int. Ed. 57 (2018) 11460-11464 |
|
Research Area: C
|
|
T. Uhlemann, S. Seidel, C. W. Mueller |
Site-specific binding of a water molecule to the sulfa drugs sulfamethoxazole and sulfisoxazole: a laser-desorption isomer-specific UV and IR study |
Phys. Chem. Chem. Phys. 20 (2018) 6891-6904 |
|
Research Area: C
|
|
R. Ghafarian Shirazi, F. Neese, D. A. Pantazis |
Accurate Spin-State Energetics for Aryl Carbenes |
J. Chem. Theory Comput. 14 (2018) 4733-4746 |
|
Research Area: A
|
|
Y. Guo, C. Riplinger, U. Becker, D. G. Liakos, Y. Minenkov, L. Cavallo, F. Neese |
Communication: An improved linear scaling perturbative triples correction for the domain based local pair-natural orbital based singles and doubles coupled cluster method [DLPNO-CCSD(T)] |
J. Chem. Phys. 148 (2018) 011101 |
|
Research Area: A
|
|
Y. Guo, U. Becker, F. Neese |
Comparison and combination of "direct" and fragment based local correlation methods: Cluster in molecules and domain based local pair natural orbital perturbation and coupled cluster theories |
J. Chem. Phys. 148 (2018) 124117 |
|
Research Area: A
|
|
S. Surendralal, M. Todorova, M. W. Finnis, J. Neugebauer |
First-Principles Approach to Model Electrochemical Reactions: Understanding the Fundamental Mechanisms behind Mg Corrosion |
Phys. Rev. Lett. 120 (2018) 246801 |
|
Research Area: C
|
|
S.-H. Yoo, M. Todorova, J. Neugebauer |
Selective Solvent-Induced Stabilization of Polar Oxide Surfaces in an Electrochemical Environment |
Phys. Rev. Lett. 120 (2018) 066101 |
|
Research Area: C
|
|
H. L. Williams, B. A. Erickson, D. M. Neumark |
Time-resolved photoelectron spectroscopy of adenosine and adenosine monophosphate photodeactivation dynamics in water microjets |
J. Chem. Phys. 148 (2018) 194303 |
|
Research Area: A
|
|
K. P. Sokol, W. E. Robinson, J. Warnan, N. Kornienko, M. M. Nowaczyk, A. Ruff, J. Z. Zhang, E. Reisner |
Bias-free photoelectrochemical water splitting with photosystem II on a dye-sensitised photoanode wired to hydrogenase |
Nat. Energy 3 (2018) 944-951 |
|
Research Area: B
|
|
T. Bolze, J.-L. Wree, F. Kanal, P. Nuernberger |
Ultrafast Dynamics of a Fluorescent Tetrazolium Compound in Solution |
ChemPhysChem 19 (2018) 138-147 |
|
Research Area: A
|
|
A. Marefat Khah, L. Grimmelsmann, J. Knorr, P. Nuernberger, C. Haettig |
How a linear triazene photoisomerizes in a volume-conserving fashion |
Phys. Chem. Chem. Phys. 20 (2018) 28075-28087 |
|
Research Area: A
|
|
J. Quino, K. Franke, M. Ivanova, S. Kareth, M. Petermann, A. S. Braeuer |
In situ measurement of drug transport in porous silica gel |
Microporous Mesoporous Mater. 260 (2018) 17-23 |
|
Research Area: A
|
|
M. Ivanova, S. Kareth, M. Petermann |
Supercritical carbon dioxide and imidazolium based ionic liquids applied during the sol-gel process as suitable candidates for the replacement of classical organic solvents |
J. Supercrit. Fluids 132 (2018) 76-82 |
|
Research Area: A
|
|
G. Dresp, M. Petermann, T. M. Fieback |
Enhancement of gravimetric forced flow through system to determine sorption, swelling, and mass transfer characteristics of liquid sorbents |
Rev. Sci. Instrum. 89 (2018) 045102 |
|
Research Area: A
|
|
G. Lipinski, C. Holzammer, M. Petermann, M. Richter |
Measurement of sorption phenomena near dew points of fluid mixtures: concept for the combination of gravimetric sorption analysis and Raman spectroscopy |
Meas. Sci. Technol. 29 (2018) 105501 |
|
Research Area: A
|
|
A. A. Oughli, A. Ruff, N. Priyadarshani Boralugodage, P. Rodriguez-Macia, N. Plumere, W. Lubitz, W. J. Shaw, W. Schuhmann, O. Ruediger |
Dual properties of a hydrogen oxidation Ni-catalyst entrapped within a polymer promote self-defense against oxygen |
Nat. Commun. 9 (2018) 864 |
|
Research Area: C
|
|
X. Yang, M. A. Ben Souissi, R. Kleinrahm, M. Richter |
Vapour-phase (p, rho, T, x) behaviour and virial coefficients for the (ethane plus carbon dioxide) system |
J. Chem. Thermodyn. 122 (2018) 204-213 |
|
Research Area: A
|
|
V. Hartmann, A. Ruff, W. Schuhmann, M. Roegner, M. M. Nowaczyk |
Analysis of photosystem II electron transfer with natural PsbA-variants by redox polymer/protein biophotoelectrochemistry |
Photosynthetica 56 (2018) 229-235 |
|
Research Area: B,C
|
|
F. Zhao, S. Hardt, V. Hartmann, H. Zhang, M. M. Nowaczyk, M. Roegner, N. Plumere, W. Schuhmann, F. Conzuelo |
Light-induced formation of partially reduced oxygen species limits the lifetime of photosystem 1-based biocathodes |
Nat. Commun. 9 (2018) 1973 |
|
Research Area: B,C
|
|
P. Grosse, D. Gao, F. Scholten, I. Sinev, H. Mistry, B. Roldan Cuenya |
Dynamic Changes in the Structure, Chemical State and Catalytic Selectivity of Cu Nanocubes during CO2 Electroreduction: Size and Support Effects |
Angew. Chem. Int. Ed. 57 (2018) 6192-6197 |
|
Research Area: C
|
|
Y. Sun, I. Sinev, W. Ju, A. Bergmann, S. Dresp, S. Kuehl, C. Spoeri, H. Schmies, H. Wang, D. Bernsmeier, B. Paul, R. Schmack, R. Kraehnert, B. Roldan Cuenya, P. Strasser |
Efficient electrochemical hydrogen peroxide production from molecular oxygen on nitrogen-doped mesoporous carbon catalysts |
ACS Catal. 8 (2018) 2844-2856 |
|
Research Area: C
|
|
H. S. Jeon, S. Kunze, F. Scholten, B. Roldan Cuenya |
Prism-shaped Cu nanocatalysts for electrochemical CO2 reduction to ethylene |
ACS Catal. 8 (2018) 531-535 |
|
Research Area: C
|
|
L. Pielsticker, I. Zegkinoglou, N. J. Divins, H. Mistry, Y.-T. Chen, A. Kostka, J. A. Boscoboinik, B. Roldan Cuenya |
Segregation phenomena in size-selected bimetallic CuNi nanoparticle catalysts |
J. Phys. Chem. B 122 (2018) 919-926 |
|
Research Area: C
|
|
V. Jakobi, J. Schwarze, J. A. Finlay, K. A. Nolte, S. Spoellmann, H.-W. Becker, A. S. Clare, A. Rosenhahn |
Amphiphilic Alginates for Marine Antifouling Applications |
Biomacromolecules 19 (2018) 402-408 |
|
Research Area: C
|
|
A. Ruff, X. Qian, K. Porfyrakis, S. Ludwigs |
Effect of the Type and Number of Organic Addends on Fullerene Acceptors for n-Type Electronic Devices: Redox Properties and Energy Levels |
ChemistrySelect 3 (2018) 5778-5785 |
|
Research Area: C
|
|
K. Bruchlos, D. Trefz, A. Hamidi-Sakr, M. Brinkmann, J. Heinze, A. Ruff, S. Ludwigs |
Poly(3-hexylthiophene) revisited - Influence of film deposition on the electrochemical behaviour and energy levels |
Electrochim. Acta 269 (2018) 299-311 |
|
Research Area: C
|
|
A. Wangler, D. Boetcher, A. Hueser, G. Sadowski, C. Held |
Prediction and experimental validation of co-solvent influence on Michaelis constants: A thermodynamic activity-based approach |
Chem. Eur. J 24 (2018) 16418-16425 |
|
Research Area: B
|
|
A. Wangler, C. Schmidt, G. Sadowski, C. Held |
Standard Gibbs Energy of Metabolic Reactions: III The 3-Phosphoglycerate Kinase Reaction |
ACS Omega 3 (2018) 1783-1790 |
|
Research Area: B
|
|
A. Wangler, M. J. Bunse, G. Sadowski, C. Held |
Thermodynamic Activity-Based Michaelis Constants |
In Kinetics of Enzymatic Synthesis by L. Rajendran, C. Fernandez, IntechOpen (2018) Chapter 2 |
|
Research Area: B
|
|
B. Shen, J. Tatchen, E. Sanchez-Garcia, H. F. Bettinger |
Evolution of the Optical Gap in the Acene Series: Undecacene |
Angew. Chem. Int. Ed. 57 (2018) 10506-10509 |
|
Research Area: A
|
|
S. Mittal, K. Bravo-Rodriguez, E. Sanchez-Garcia |
Mechanism of Inhibition of Beta Amyloid Toxicity by Supramolecular Tweezers |
J. Phys. Chem. B 122 (2018) 4196-4205 |
|
Research Area: B
|
|
E. Yilmaz, D. Bier, X. Guillory, J. Briels, Y. B. Ruiz-Blanco, E. Sanchez-Garcia, C. Ottmann, M. Kaiser |
Mono- and bivalent 14-3-3 inhibitors for characterizing supramolecular 'lysine wrapping' of oligoethylene glycol (OEG) moieties in proteins |
Chem. Eur. J. 24 (2018) 13807-13814 |
|
Research Area: B
|
|
A. S. Wagner, A. Z. Politi, A. Ast, K. Bravo-Rodriguez, K. Baum, A. Buntru, N. U. Strempel, L. Brusendorf, C. Haenig, A. Boeddrich, S. Plassmann, K. Klockmeier, J. M. Ramirez-Anguita, E. Sanchez-Garcia, J. Wolf, E. E. Wanker |
Self-assembly of Mutant Huntingtin Exon-1 Fragments into Large Complex Fibrillar Structures Involves Nucleated Branching |
J. Mol. Biol. 430 (2018) 1725-1744 |
|
Research Area: B
|
|
N. Schulz, P. Sokkar, E. Engelage, S. Schindler, M. Erdelyi, E. Sanchez-Garcia, S. M. Huber |
The Interaction Modes of Haloimidazolium Salts in Solution |
Chem. Eur. J. 24 (2018) 3464-3473 |
|
Research Area: A
|
|
M. Dirkmann, J. Iglesias-Fernandez, V. Munoz, P. Sokkar, C. Rumancev, A. von Gundlach, O. Krenczyk, T. Voepel, J. Nowack, M. A. Schroer, S. Ebbinghaus, C. Herrmann, A. Rosenhahn, E. Sanchez-Garcia, F. Schulz |
A Multiperspective Approach to Solvent Regulation of Enzymatic Activity: HMG-CoA Reductase |
Chem. Bio. Chem. 19 (2018) 153-158 |
|
Research Area: B
|
|
S. Shankar, M. Peters, K. Steinborn, B. Krahwinkel, F. D. Soennichsen, D. Grote, W. Sander, T. Lohmiller, O. Ruediger, R. Hernges |
Light-controlled switching of the spin state of iron(III) |
Nat. Commun. 9 (2018) 4750 |
|
Research Area: A
|
|
A. H. Raut, P. Costa, W. Sander |
Reactions of Arylcarbenes with Lewis Acids |
Chem. Eur. J. 24 (2018) 18043-18051 |
|
Research Area: A
|
|
J. Mieres-Perez, P. Costa, E. Mendez-Vega, R. Chrespo-Otero, W. Sander |
Switching the Spin State of Pentafluorophenylnitrene: Isolation of a Singlet Arylnitrene Complex |
J. Am. Chem. Soc. 140 (2018) 17271 17277 |
|
Research Area: A
|
|
S. Radhakrishnan, M. S. Gudipati, W. Sander, A. Lignell |
Photochemical processes in CO2/H2O Ice mixtures with trapped pyrene, a model polycyclic aromatic hydrocarbon |
Astrophys. J. 864 (2018) 151-159 |
|
Research Area: A
|
|
E. Mendez-Vega, M. Maehara, A. H. Raut, J. Mieres-Perez, M. Tsuge, Y.-P. Lee, W. Sander |
Activation of Molecular Hydrogen by Arylcarbenes |
Chem. Eur. J. 24 (2018) 18801-18808 |
|
Research Area: A
|
|
S. Henkel, I. Trosien, J. Mieres-Perez, T. Lohmiller, A. Savitsky, E. Sanchez-Garcia, W. Sander |
Reactions of Cyclopentadienylidenes with CF3I: Electron Bond Donation versus Halogen Bond Donation of the Iodine Atom |
J. Org. Chem. 83 (2018) 7586-7592 |
|
Research Area: A
|
|
C. Paradis, J. Drs, N. Modsching, O. Razskazovskaya, F. Meyer, C. Kraenkel, C. J. Saraceno, V. Wittwer, T. Suedmeyer |
Broadband terahertz pulse generation driven by an ultrafst thin-disk laser oscillator |
Opt. Express 26 (2018) 26377-26384 |
|
Research Area: C
|
|
F. O. Ilday, D. K. Kesim, M. Hoffmann, C. J. Saraceno |
Discrete similariton and dissipative soliton modelocking for energy scaling ultrafast thin-disk laser oscillators |
IEEE J. Sel. Top. Quantum Electron. 24 (2018) 1102712 |
|
Research Area: A
|
|
C. J. Saraceno |
Mode-locked thin-disk lasers and their potential application for high-power terahertz generation |
J. Opt. 20 (2018) 44010 |
|
Research Area: A
|
|
F. Meyer, N. Hekmat, S. Mansourzadeh, F. Fobbe, F. Aslani, M. Hoffmann, C. J. Saraceno |
Optical rectification of a 100 W average power mode-locked thin-disk oscillator |
Opt. Lett. 43 (2018) 5909-5912 |
|
Research Area: A
|
|
A. Diebold, F. Saltarelli, I. J. Graumann, C. J. Saraceno, C. R. Phillips, U. Keller |
Gas-lens effect in kW-class thin-disk lasers |
Opt. Express 26 (2018) 12648-12659 |
|
Research Area: A
|
|
A. Mukhopadhyay, S. S. Xantheas, R. J. Saykally |
The water dimer II: Theoretical investigations |
Chem. Phys. Lett. 700 (2018) 163-175 |
|
Research Area: A
|
|
W. T. S. Cole, J. D. Farrell, A. A. Sheikh, O. Yoender, R. S. Fellers, M. R. Viant, D. J. Wales, R. J. Saykally |
Terahertz VRT spectroscopy of the water hexamer-d prism: Dramatic enhancement of bifurcation tunneling upon librational excitation |
J. Chem. Phys. 148 (2018) 94301 |
|
Research Area: A
|
|
F. Hoffmann, F. A. A. Mulder, L. V. Schaefer |
Accurate Methyl Group Dynamics in Protein Simulations with AMBER Force Fields |
J. Phys. Chem. B 122 (2018) 5038-5048 |
|
Research Area: B
|
|
F. Hoffmann, M. Xue, L. V. Schaefer, F. A. A. Mulder |
Narrowing the Gap Between Experimental and Computational Determination of Methyl Group Dynamics in Proteins |
Phys. Chem. Chem. Phys. 20 (2018) 24577-24590 |
|
Research Area: B
|
|
M. Priess, H. Goeddeke, G. Groenhof, L. V. Schaefer |
Molecular Mechanism of ATP Hydrolysis in an ABC Transporter |
ACS Cent. Sci. 4 (2018) 1334-1343 |
|
Research Area: B
|
|
D. Pache, R. Schmid |
Molecular Dynamics Investigation of the Dielectric Decrement of Ion Solutions |
ChemElectroChem 5 (2018) 1444-1450 |
|
Research Area: C
|
|
J. Keupp, R. Schmid |
TopoFF: MOF structure prediction using specifically optimized blue prints |
Faraday Discuss. 211 (2018) 79-101 |
|
Research Area: A
|
|
T. M. Benedetti, C. Andronescu, S. Cheong, P. Wilde, J. Wordsworth, M. Kientz, R. D. Tilley, W. Schuhmann, J. J. Gooding |
Electrocatalytic Nanoparticles That Mimic the Three-Dimensional Geometric Architecture of Enzymes: Nanozymes |
J. Am. Chem. Soc. 140 (2018) 13449-13455 |
|
Research Area: B
|
|
G. Garcia, S. Dieckhofer, W. Schuhmann, E. Ventosa |
Exceeding 6500 cycles for LiFePO4/Li metal batteries through understanding pulsed charging protocols |
J. Mater. Chem. A 6 (2018) 4746-4751 |
|
Research Area: C
|
|
D. Koster, P. Gutkowski, J. Masa, W. Schuhmann |
H2 quantification based on selective pre-concentration and oxidative stripping at Pd modified microelectrodes |
J. Electroanal. Chem. 812 (2018) 207-212 |
|
Research Area: C
|
|
P. Wilde, S. Barwe, C. Andronescu, W. Schuhmann, E. Ventosa |
High resolution, binder-free investigation of the intrinsic activity of immobilized NiFe LDH nanoparticles on etched carbon nanoelectrodes |
Nano Res. 11 (2018) 6034-6044 |
|
Research Area: C
|
|
C. Andronescu, S. Seisel, P. Wilde, S. Barwe, J. Masa, Y.-T. Chen, E. Ventosa, W. Schuhmann |
Influence of Temperature and Electrolyte Concentration on the Structure and Catalytic Oxygen Evolution Activity of NiFe LDH |
Chem. Eur. J. 24 (2018) 13773-13777 |
|
Research Area: B
|
|
A. Botz, J. Clausmeyer, D. Oehl, T. Tarnev, D. Franzen, T. Turek, W. Schuhmann |
Local Activities of Hydroxide and Water Determine the Operation of Ag-Based Oxygen Depolarized Cathodes |
Angew. Chem. Int. Ed. 57 (2018) 12285-12289 |
|
Research Area: C
|
|
J. Clausmeyer, M. Nebel, S. Gruetzke, Y. U. Kayran, W. Schuhmann |
Local Surface Modifications Investigated by Combining Scanning Electrochemical Microscopy and Surface-Enhanced Raman Scattering |
ChemPlusChem 83 (2018) 414-417 |
|
Research Area: C
|
|
T. Bobrowski, W. Schuhmann |
Long-term implantable glucose biosensors |
Curr. Opin. Electrochem. 10 (2018) 112-119 |
|
Research Area: C
|
|
M. Marquitan, T. Bobrowski, A. Ernst, P. Wilde, J. Clausmeyer, A. Ruff, W. Schuhmann |
Miniaturized Amperometric Glucose Sensors Based on Polymer/ Enzyme Modified Carbon Electrodes in the Sub-Micrometer Scale |
J. Electrochem. Soc 165 (2018) G3008-G3014 |
|
Research Area: C
|
|
V. Brasiliense, J. Clausmeyer, P. Berto, G. Tessier, C. Combellas, W. Schuhmann, F. Kanoufi |
Monitoring Cobalt-Oxide Single Particle Electrochemistry with Subdiffraction Accuracy |
Anal. Chem. 90 (2018) 7341-7348 |
|
Research Area: C
|
|
M. Ertl, C. Andronescu, J. Moir, M. Zobel, F. E. Wagner, S. Barwe, G. Ozin, W. Schuhmann, J. Breu |
Oxygen Evolution Catalysis with Moessbauerite - A Trivalent Iron-Only Layered Double Hydroxide |
Chem. Eur. J 24 (2018) 9004-9008 |
|
Research Area: C
|
|
D. Oehl, J. Clausmeyer, S. Barwe, A. Botz, W. Schuhmann |
Oxygen Reduction Activity and Reversible Deactivation of Single Silver Nanoparticles during Particle Adsorption Events |
ChemElectroChem 5 (2018) 1886-1890 |
|
Research Area: C
|
|
T. Bobrowski, E. Gonzalez Arribas, R. Ludwig, M. D.Toscano, S. Shleev, W. Schuhmann |
Rechargeable, flexible and mediator-free biosupercapacitor based on transparent ITO nanoparticle modified electrodes acting in mu M glucose containing buffers |
Biosens. Bioelectron. 101 (2018) 84-89 |
|
Research Area: C
|
|
W. Jaikaew, A. Ruff, P. Khunkaewla, T. Erichsen, W. Schuhmann, A. Schulte |
Robotic microplate voltammetry for real-time hydrogel drug release testing |
Anal. Chim. Acta 1041 (2018) 33-39 |
|
Research Area: C
|
|
V. Essmann, C. Santana Santos, T. Tarnev, M. Bertotti, W. Schuhmann |
Scanning Bipolar Electrochemical Microscopy |
Anal. Chem. 90 (2018) 6267-6274 |
|
Research Area: C
|
|
F. Conzuelo, A. Ruff, W. Schuhmann |
Self-powered bioelectrochemical devices |
Curr. Opin. Electrochem. 12 (2018) 156-163 |
|
Research Area: C
|
|
F. Conzuelo, N. Markovic, A. Ruff, W. Schuhmann |
The Open Circuit Voltage in Biofuel Cells: Nernstian Shift in Pseudocapacitive Electrodes / Ueber die Leerlaufspannung von Biobrennstoffzellen: Nernstverschiebung bei pseudokapazitiven Elektroden |
Angew. Chem. Int. Ed. 57 (2018) 13681-13685 |
|
Research Area: C
|
|
L. Gloag, T. M. Benedetti, S. Cheong, Y. Li, X.-H. Chan, L.-M. Lacroix, S. L. Y. Chang, R. Arenal?, I. Florea, H. Barron, A. S. Barnard, A. M. Henning, C. Zhao, W. Schuhmann, J. Gooding, R. D. Tilley |
Three-Dimensional Branched and Faceted Gold-Ruthenium Nanoparticles: Using Nanostructure to Improve Stability in Oxygen Evolution Electrocatalysis |
Angew. Chem. Int. Ed. 57 (2018) 10241-10245 |
|
Research Area: C
|
|
P. Wilde, T. Quast, H. B. Aiyappa, A. Botz, T. Tarnev, M. Marquitan, S. Feldhege, A. Lindner, C. Andronescu, W. Schuhmann |
Towards Reproducible Fabrication of Nanometre-Sized Carbon Electrodes: Optimisation of Automated Nanoelectrode Fabrication by Means of Transmission Electron Microscopy |
ChemElectroChem 5 (2018) 3083-3088 |
|
Research Area: C
|
|
S. Teanphonkrang, S. Janke, P. Chaiyen, J. Sucharitaku , W. Suginta, P. Khunkaewla, W. Schuhmann, A. Ruff, A. Schulte |
Tuned Amperometric Detection of Reduced beta-Nicotinamide Adenine Dinucleotide by Allosteric Modulation of the Reductase Component of the p-Hydroxyphenylacetate Hydroxylase Immobilized within a Redox Polymer |
Anal. Chem. 90 (2018) 5703-5711 |
|
Research Area: B,C
|
|
A. A. Oughli, M. Velez, J. A. Birrella, W. Schuhmann, W. Lubitz, N. Plumere, O. Ruediger |
Viologen-modified electrodes for protection of hydrogenases from high potential inactivation while performing H2?oxidation at low overpotential |
Dalton Trans. 47 (2018) 10685-10691 |
|
Research Area: C
|
|
D. Hiltrop, S. Cychy, K. Elumeeva, W. Schuhmann, M. Muhler |
Spectroelectrochemical studies on the effect of cations in the alkaline glycerol oxidation reaction over carbon nanotube-supported Pd nanoparticles |
Beilstein J. Org. Chem. 14 (2018) 1428-1435 |
|
Research Area: C
|
|
G. Kopiec, K. Starzec, J. Kochana, T. P. Kinnunen-Skidmore, W. Schuhmann, W. H. Campbell, A. Ruff, N. Plumere |
Bioelectrocatalytic and electrochemical cascade for phosphate sensing with up to 6 electrons per analyte molecule |
Biosens. Bioelectron. 117 (2018) 501-507 |
|
Research Area: B
|
|
F. Y. Zhao, V. Hartmann, A. Ruff, M. N. Nowaczyk, M. Roegner, W. Schuhmann, F. Conzuelo |
Unravelling electron transfer processes at photosystem 2 embedded in an Os-complex modified redox polymer |
Electrochim. Acta 290 (2018) 451-456 |
|
Research Area: C
|
|
T. Loeffler, P. Wilde, D. Oehla, Y.-T. Chen, K. Tschulik, W. Schuhmann |
Evaluation of the intrinsic catalytic activity of nanoparticles without prior knowledge of the mass loading |
Faraday Discuss. 210 (2018) 317-332 |
|
Research Area: C
|
|
M. Dirkmann, J. Nowack, F. Schulz |
An in vitro Biosynthesis of Sesquiterpenes starting from Acetic Acid |
ChemBioChem 19 (2018) 2146-2151 |
|
Research Area: B
|
|
D. Moeller, S. Kushnir, M. Grote, A. Ismail-Ali, K. R. M. Koopmans, F. Calo, S. Heinrich, B. Diehl, F. Schulz |
Flexible enzymatic activation of artificial polyketide extender units by Streptomyces cinnamonensis into the monensin biosynthetic pathway |
Lett. Appl. Microbiol. 67 (2018) 226-234 |
|
Research Area: B
|
|
Y. Xiong, D. Gu, X. Denga, H. Tueysuez, M. van Gastel, F. Schueth, F. Marlow |
High surface area black TiO2 templated from ordered mesoporous carbon for solar driven hydrogen evolution |
Microporous Mesoporous Mater. 268 (2018) 162-169 |
|
Research Area: A
|
|
C. Strippel, L. Tomala, K. Sommer |
A cross-subject content analysis of science textbooks using the understandings about scientific inquiry rubrics |
RISTAL 1 (2018) 66-81 |
|
Research Area: -
|
|
S. Kenmoe, O. Lisovski, S. Piskunov, D. Bocharov, Y. F. Zhukovskii, E. Spohr |
Water Adsorption on Clean and Defective Anatase TiO2 (001) Nanotube Surfaces: A Surface Science Approach |
J. Phys. Chem. B 122 (2018) 5432-5440 |
|
Research Area: C
|
|
G. Koenig, M. T. Reetz, W. Thiel |
1-Butanol as a Solvent for Efficient Extraction of Polar Compounds from Aqueous Medium: Theoretical and Practical Aspects |
J. Phys. Chem. B 122 (2018) 6975-6988 |
|
Research Area: A
|
|
Y. Forov, M. Paulus, S. Dogan, P. Salmen, C. Weis, T. Gahlmann, A. Behrendt, C. Albers, M. Elbers, W. Schnettger, S. Egger, E. Zwar, H. Rehage, I. Kiesel, T. Riedl, M. Tolan |
Adsorption Behavior of Lysozyme at Titanium Oxide-Water Interfaces |
Langmuir 34 (2018) 5403-5408 |
|
Research Area: B
|
|
S. Dogan, M. Paulus, Y. Forov, C. Weis, M. Kampmann, C. Cewe, I. Kiesel, P. Degen, P. Salmen, H. Rehage, M. Tolan |
Human Apolipoprotein A1 at Solid/Liquid and Liquid/Gas Interfaces |
J. Phys. Chem. B 122 (2018) 3953-3960 |
|
Research Area: C
|
|
K. Julius, S. R. Al-Ayoubi, M. Paulus, M. Tolan, R. Winter |
The effects of osmolytes and crowding on the pressure-induced dissociation and inactivation of dimeric LADH |
Phys. Chem. Chem. Phys. 20 (2018) 7093-7104 |
|
Research Area: B
|
|
K. Julius, J. Weine, M. Berghaus, N. Koenig, M. Gao, J. Latarius, M. Paulus, M. A. Schroer, M. Tolan, R. Winter |
Water-Mediated Protein-Protein Interactions at High Pressures are Controlled by a Deep-Sea Osmolyte |
Phys. Rev. Lett. 121 (2018) 38101 |
|
Research Area: B
|
|
V. Grasmik, C. Rurainsky, K. Loza, M. Evers, O. Prymak, M. Heggen, K. Tschulik, M. Epple |
Deciphering the Surface Composition and the Internal Structure of Alloyed Silver-Gold Nanoparticles |
Chem. Eur. J. 24 (2018) 9051-9060 |
|
Research Area: C
|
|
K. Kanokkanchana, E. N. Saw, K. Tschulik |
Nano Impact Electrochemistry: Effects of Electronic Filtering on Peak Height, Duration and Area |
ChemElectroChem 5 (2018) 3000-3005 |
|
Research Area: C
|
|
K. Wonner, M. V. Evers, K. Tschulik |
Simultaneous Opto- and Spectro-Electrochemistry: Reactions of Individual Nanoparticles Uncovered by Dark-Field Microscopy |
J. Am. Chem. Soc. 140 (2018) 12658-12661 |
|
Research Area: C
|
|
V. Brasiliense, J.-M. Noel, K. Wonner, K. Tschulik, C. Combellas, F. Kanoufi |
Single Nanoparticle Growth from Nanoparticle Tracking Analysis: From Monte Carlo Simulations to Nanoparticle Electrogeneration |
ChemElectroChem 5 (2018) 3036-3043 |
|
Research Area: C
|
|
M. Evers, K. Wonner, K. Tschulik |
Spannung im Dunkelfeld |
Nachrichten aus der Chemie 66 (2018) 1153-1156 |
|
Research Area: C
|
|
E. N. Saw, N. Blanc, K. Kanokkanchana, K. Tschulik |
Time-resolved impact electrochemistry - A new method to determine diffusion coefficients of ions in solution |
Electrochim. Acta 282 (2018) 317-327 |
|
Research Area: C
|
|
G. Bertoli, B. Exner, M. V. Evers, K. Tschulik, L. J. Goossen |
Metal-free trifluoromethylthiolation of arenediazonium salts with Me4NSCF3 |
J. Fluor. Chem. 210 (2018) 132-136 |
|
Research Area: A
|
|
S. Schuenemann, M. van Gastel, H. Tueysuez |
A CsPbBr3/TiO2 Composite for Visible-Light Driven Photocatalytic Benzyl Alcohol Oxidation |
ChemSusChem 11 (2018) 2057-2061 |
|
Research Area: A
|
|
S. Schuenemann, H. Tueysuez |
An Inverse Opal Structured Halide Perovskite Photocatalyst |
Eur. J. Inorg. Chem. 20-21 (2018) 2350-2355 |
|
Research Area: A
|
|
A. Pougin, G. Dodekatos, M. Dilla, H. Tueysuez, J. Strunk |
Au@TiO2 Core-Shell Composites for the Photocatalytic Reduction of CO2 |
Chem. Eur. J. 24 (2018) 12416-12425 |
|
Research Area: A
|
|
G. Dodekatos, J. Ternieden, S. Schuenemann, C. Weidenthaler, H. Tueysuez |
Promoting effect of solvent on Cu/CoO catalyst for selective glycerol oxidation under alkaline conditions |
Catal. Sci. Technol. 8 (2018) 4891-4899 |
|
Research Area: A
|
|
G. Dodekatos, S. Schuenemann, H. Tueysuez |
Recent Advances in Thermo-, Photo-, and Electrocatalytic Glycerol Oxidation |
ACS Catal. 8 (2018) 6301-6333 |
|
Research Area: A
|
|
K. Chen, S. Schuenemann, S. Song, H. Tueysuez |
Structural effects on optoelectronic properties of halide perovskites |
Chem. Soc. Rev. 47 (2018) 7045-7077 |
|
Research Area: A
|
|
G. Dodekatos, L. Abis, S. J. Freakley, H. Tueysuez, G. J. Hutchings |
Glycerol Oxidation Using MgO- and Al2O3-supported Gold and Gold-Palladium Nanoparticles Prepared in the Absence of Polymer Stabilizers |
ChemCatChem 10 (2018) 1351-1359 |
|
Research Area: A
|
|
G.-H. Wang, K. Chen, J. Engelhardt, H. Tueysuez, H.-J. Bongard, W. Schmidt, F. Schueth |
Scalable One-Pot Synthesis of Yolk-Shell Carbon Nanospheres with Yolk-Supported Pd Nanoparticles for Size-Selective Catalysis |
Chem. Mater. 30 (2018) 2483-2487 |
|
Research Area: A
|
|
E. Weidner |
Impregnation via supercritical CO2 - What we know and what we need to know |
J. Supercrit. Fluids 134 (2018) 220-227 |
|
Research Area: A
|
|
R. Scholz, L. Davico, V. Jakobi, S. Kareth, A. Rosenhahn, E. Weidner |
Verkapselungseffizienz und Freisetzungsverhalten fettbasierter Mikrokapseln mit lipophilen Emulgatoren / Encapsulation efficiency and release behavior of fat microcapsules with lipophilic emulsifiers |
Chem. Ing. Tech. (Weinh.) 90 (2018) 562-567 |
|
Research Area: C
|
|
M. J. DiTucci, C. N. Stachl, E. R. Williams |
Long Distance Ion-Water Interactions in Aqueous Sulfate Nandrops Persist to Ambient Temperatures in the Upper Atmosphere |
Chem. Sci. 9 (2018) 3970-3977 |
|
Research Area: A
|
|
S. Patra, C. Anders, P. H. Schummel, R. Winter |
Antagonistic effects of natural osmolyte mixtures and hydrostatic pressure on the conformational dynamics of a DNA hairpin probed at the single-molecule level |
Phys. Chem. Chem. Phys. 20 (2018) 13159-13170 |
|
Research Area: B
|
|
S. R. Al-Ayoubi, P. K. F. Schinkel, M. Berghaus, M. Herzog, R. Winter |
Combined effects of osmotic and hydrostatic pressure on multilamellar lipid membranes in the presence of PEG and trehalose |
Soft Matter 14 (2018) 8792-8802 |
|
Research Area: B
|
|
P. H. Schummel, M. W. Jaworek, C. Rosin, J. Hogg, R. Winter |
Exploring the influence of natural cosolvents on the free energy and conformational landscape of filamentous actin and microtubules |
Phys. Chem. Chem. Phys. 20 (2018) 28400-28411 |
|
Research Area: B
|
|
Y. Zhang, M. Berghaus, S. Klein, K. Jenkins, S. Zhang, S. A. McCallum, J. E. Morgan, R. Winter, D. Barrick, C. A. Royer |
High-Pressure NMR and SAXS Reveals How Capping Modulates Folding Cooperativity of the pp32 Leucine-rich Repeat Protein |
J. Mol. Biol. 430 (2018) 1336 |
|
Research Area: B
|
|
M. Gao, M. Berghaus, S. Moebitz, V. Schuabb, N. Erwin, M. Herzog, K. Julius, C. Sternemann, R. Winter |
On the Origin of Microtubules' High-Pressure Sensitivity |
Biophys. J. 114 (2018) 1080-1090 |
|
Research Area: B
|
|
M. W. Jaworek, V. Schuabb, R. Winter |
Pressure and cosolvent modulation of the catalytic activity of amyloid fibrils |
Chem. Commun. 54 (2018) 5696-5699 |
|
Research Area: B
|
|
H. Cinar, S. Cinar, H. S. Chan, R. Winter |
Pressure-Induced Dissolution and Reentrant Formation of Condensed, Liquid-Liquid Phase-Separated Elastomeric alpha-Elastin |
Chem. Eur. J. 24 (2018) 8286-8291 |
|
Research Area: B
|
|
J.-M. Knop, S. Patra, B. Harish, C. A. Royer, R. Winter |
The Deep Sea Osmolyte Trimethylamine N-Oxide and Macromolecular Crowders Rescue the Antiparallel Conformation of the Human Telomeric G-Quadruplex from Urea and Pressure Stress |
Chem. Eur. J. 24 (2018) 14346-14351 |
|
Research Area: B
|
|
L. Arns, V. Schuabb, S. Meichsner, M. Berghaus, R. Winter |
The Effect of Natural Osmolyte Mixtures on the Temperature-Pressure Stability of the Protein RNase A |
Z. Phys. Chem. (N F) 232 (2018) 615-634 |
|
Research Area: B
|
|
M. W. Jaworek, V. Schuabb, R. Winter |
The effects of glycine, TMAO and osmolyte mixtures on the pressure dependent enzymatic activity of alpha-chymotrypsin |
Phys. Chem. Chem. Phys. 20 (2018) 1347-1354 |
|
Research Area: B
|
|
L. Grimmelsmann, V. Schuabb, B. Tekin, R. Winter, P. Nuernberger |
Impact of kilobar pressures on ultrafast triazene and thiacyanine photodynamics |
Phys. Chem. Chem. Phys. 20 (2018) 18169-18175 |
|
Research Area: A
|
|
A. Wangler, R. Canales, C. Held, T. Q. Luong, R. Winter, D. H. Zaitsau, S. P. Verevkin, G. Sadowski |
Co-solvent effects on reaction rate and reaction equilibrium of an enzymatic peptide hydrolysis |
Phys. Chem. Chem. Phys. 20 (2018) 11317-11326 |
|
Research Area: B
|
|
O. Lampret, A. Adamska-Venkatesh, H. Konegger, F. Wittkamp, U. P. Apfel, E. J. Reijerse, W. Lubitz, O. Ruuediger, T. Happe, M. Winkler |
Interplay between CN- Ligands and the Secondary Coordination Sphere of the H-Cluster in [FeFe]-Hydrogenases |
J. Am. Chem. Soc 139 (2017) 18222-18230 |
|
Research Area: B
|
|
V. Quaranta, M. Hellstroem, J. Behler |
Proton Transfer Mechanisms at the Water-ZnO Interface: The Role of Presolvation |
J. Phys. Chem. Lett. 8 (2017) 1476-1483 |
|
Research Area: C
|
|
M. Hellstroem, J. Behler |
Proton-Transfer-Driven Water Exchange Mechanism in the Na+ Solvation Shell |
J. Phys. Chem. B 121 (2017) 4184-4190 |
|
Research Area: A
|
|
S. Kondati Natarajan, J. Behler |
Self-diffusion of Surface Defects at Copper-Water Interfaces |
J. Phys. Chem. C 121 (2017) 4368-4383 |
|
Research Area: C
|
|
M. Hellstroem, J. Behler |
Structure of aqueous NaOH solutions: insights from neural network-based molecular dynamics simulations |
Phys. Chem. Chem. Phys. 19 (2017) 82-96 |
|
Research Area: A
|
|
S. Bleicken, A. Hantusch, K. K. Das, T. Frickey, A. J. Garcia-Saez |
Quantitative interactome of a membrane Bcl-2 network identifies a hierarchy of complexes for apoptosis regulation |
Nat. Commun. 8 (2017) 73 |
|
Research Area: B
|
|
M. H. Timachi, C. A. J. Hutter, M. Hohl, T. Assafa, S. Boehm, A. Mittal, M. A. Seeger, E. Bordignon |
Exploring conformational equilibria of a heterodimeric ABC transporter |
eLife 6 (2017) e20236 |
|
Research Area: B
|
|
Y. Fernandez-Marrero, S. Bleicken, K. K. Das, D. Bachmann, T. Kaufmann, A. J. Garcia-Saez |
The membrane activity of BOK involves formation of large, stable toroidal pores and is promoted by cBID |
FEBS J. 284 (2017) 711-724 |
|
Research Area: B
|
|
S. Loeffler, A. Wuttke, B. Zhang, J. J. Holstein, R. A. Mata, G. H. Clever |
Influence of Size, Shape, Heteroatom Content and Dispersive Contributions on Guest Binding in a Coordination Cage |
Chem. Commun. 53 (2017) 11933-11936 |
|
Research Area: B
|
|
M. Sallouh, M. Jarocki, O. Sallouh, P. Degen, A. Faissner, R. Weberskirch |
The Synergistic Effect of Cationic Moieties and GRGDSF-Peptides in Hydrogels on Neural Stem Cell Behavior |
Macromol. Biosci. 17 (2017) 1600178 |
|
Research Area: B
|
|
S. Buening, A. Sharma, S. Vachharajani, E. Newcombe, A. Ormsby, M. Gao, D. Gnutt, T. Voepel, D. M. Hatters, S. Ebbinghaus |
Conformational dynamics and self-association of intrinsically disordered Huntingtin exon 1 in cells |
Phys. Chem. Chem. Phys. 19 (2017) 10738-10747 |
|
Research Area: B
|
|
D. Gnutt, O. Brylski, E. Edengeiser, M. Havenith, S. Ebbinghaus |
Imperfect crowding adaptation of mammalian cells towards osmotic stress and its modulation by osmolytes |
Mol. Biosyst. 13 (2017) 2218-2221 |
|
Research Area: B
|
|
A. Ganguly, T. Luong, O. Brylski, M. Dirkmann, D. Moeller, S. Ebbinghaus, F. Schulz, R. Winter, E. Sanchez-Garcia, W. Thiel |
Elucidation of the Catalytic Mechanism of a Miniature Zinc Finger Hydrolase |
J. Phys. Chem. B 121 (2017) 6390-6398 |
|
Research Area: B
|
|
F. Niu, R. Schulz, A. Castaneda Medina, R. Schmid, A. Erbe |
Electrode potential dependent desolvation and resolvation of germanium(100) in contact with aqueous perchlorate electrolytes |
Phys. Chem. Chem. Phys. 19 (2017) 13585-13595 |
|
Research Area: C
|
|
S. Wannapaiboon, K. Sumida, K. Dilchert, M. Tu, S. Kitagawa, S. Furukawa, R. A. Fischer |
Enhanced properties of metal-organic framework thin films fabricated via a coordination modulation-controlled layer-by-layer process |
J. Mater. Chem. A 5 (2017) 13665-13673 |
|
Research Area: C
|
|
A. Schneemann, R. Rudolf, S. Henke, Y. Takahashi, H. Banh, I. Hante, C. Schneider, S. I. Noro, R. A. Fischer |
Linker functionalisation triggers an alternative 3D-topology for Zn-isophthalate-4,4'-bipyridine frameworks |
Dalton Trans. 46 (2017) 8198-8203 |
|
Research Area: C
|
|
A. Aijaz, J. Masa, C. Roesler, H. Antoni, R. A. Fischer, W. Schuhmann, M. Muhler |
MOF-Templated Assembly Approach for Fe3C Nanoparticles Encapsulated in Bamboo-Like N-Doped CNTs: Highly Efficient Oxygen Reduction under Acidic and Basic Conditions |
Chem. Eur. J. 23 (2017) 12125-12130 |
|
Research Area: C
|
|
S. Molitor, V. H. Gessner |
Alkali Metal Chlorine and Bromine Carbenoids: Their Thermal Stability and Structural Properties |
Chem. Eur. J. 23 (2017) 12372-12379 |
|
Research Area: A
|
|
K. F. Pfister, S. Baader, M. Baader, S. Berndt, L. J. Goossen |
Biofuel by isomerizing metathesis of rapeseed oil esters with (bio)ethylene for use in contemporary diesel engines |
Sci. Adv. 3 (2017) e1602624 |
|
Research Area: A
|
|
A. Biafora, B. Khan, J. Bahri, L. J. Goossen |
Doubly Regioselective C-H Hydroarylation of Unsymmetrical Alkynes Using Carboxylates as Deciduous Directing Groups |
Org. Lett. 19 (2017) 1232-1235 |
|
Research Area: A
|
|
S. Kovacs, B. Bayarmagnai, L. J. Goossen |
Preparation of Electrophilic Trifluormethylthio Reagents from Nucleophilic Tetramethylammonium Trifluormethylthiolate |
Adv. Synth. Catal. 359 (2017) 250-254 |
|
Research Area: A
|
|
D. Hackenberger, P. Weber, D. C. Blakemore, L. J. Goossen |
Synthesis of 3-Substituted 2-Arylpyridines via Cu/Pd-Catalyzed Decarboxylative Cross-Coupling of Picolinic Acids with (Hetero)Aryl Halides |
J. Org. Chem. 82 (2017) 3917-3925 |
|
Research Area: A
|
|
B. Exner, B. Bayarmagnai, C. Matheis, L. J. Goossen |
Synthesis of perfluoroalkyl thioethers from aromatic thiocyanates by iron-catalysed decarboxylative perfluoroalkylation |
J. Fluor. Chem. 198 (2017) 89-93 |
|
Research Area: A
|
|
A. S. Trita, L. C. Over, J. Pollini, S. Baader, S. Riegsinger, M. A. R. Meier, L. J. Goossen |
Synthesis of potential bisphenol A substitutes by isomerising metathesis of renewable raw materials |
Green Chem. 19 (2017) 3051-3060 |
|
Research Area: A
|
|
A. Biafora, L. J. Goossen |
Thieme Chemistry Journals Awardees - Where Are They Now? New Reaction Mode in Carboxylate-Directed C?H Functionalizations: Carboxylates as Deciduous Directing Groups |
Synlett 28 (2017) 1885-1890 |
|
Research Area: A
|
|
F. V. de A. Camargo, L. Grimmelsmann, H. L. Anderson, S. R. Meech, I. A. Heisler |
Resolving Vibrational from Electronic Coherences in Two-Dimensional Electronic Spectroscopy: The Role of the Laser Spectrum |
Phys. Rev. Lett. 118 (2017) 033001 |
|
Research Area: A
|
|
L. Grimmelsmann, A. Marefat Khah, J. Knorr, C. Spies, C. Haettig, P. Nuernberger |
Ultrafast Dynamics of a Triazene: Excited-State Pathways and the Impact of Binding to the Minor Groove of DNA and Further Biomolecular Systems |
J. Phys. Chem. Lett. 8 (2017) 1986-1992 |
|
Research Area: A
|
|
Y. Jho, H. Y. Yoo, Y. X. Lin, S. Han, D. S. Hwang |
Molecular and structural basis of low interfacial energy of complex coacervates in water |
Adv. Colloid Interface Sci. 239 (2017) 61-73 |
|
Research Area: B
|
|
K. Pandey, S. T. A. Islam, T. Happe, F. A. Armstrong |
Frequency and potential dependence of reversible electrocatalytic hydrogen interconversion by FeFe -hydrogenases |
Proc. Natl. Acad. Sci. U.S.A. 114 (2017) 3843-3848 |
|
Research Area: B
|
|
M. Winkler, M. Senger, J. F. Duan, J. Esselborn, F. Wittkamp, E. Hofmann, U.-P. Apfel, S. T. Stripp, T. Happe |
Accumulating the hydride state in the catalytic cycle of FeFe-hydrogenases |
Nat. Commun. 8 (2017) 16115 |
|
Research Area: B
|
|
S. Mebs, M. Senger, J. Duan, U.-P. Apfel, T. Happe, M. Winkler, S. Stripp, M. Haumann |
Bridging Hydride at Reduced H-Cluster Species in FeFe-Hydrogenases Revealed by Infrared Spectroskopy, Isotope Editing and Quantum Chemistry |
J. Am. Chem. Soc. 139 (2017) 12157-12160 |
|
Research Area: B
|
|
M. Senger, K. Laun, F. Wittkamp, J. Duan, M. Haumann, T. Happe, M. Winkler, U.-P. Apfel, S. T. Stripp |
Proton-Coupled Reduction of the Catalytic [4Fe-4S] Cluster in [FeFe]-Hydrogenases / Protonengekoppelte Reduktion des katalytischen [4Fe-4S]-Zentrums in [FeFe]-Hydrogenasen |
Angew. Chem. Int. Ed. 56 (2017) 16503-16506 |
|
Research Area: B
|
|
D. Adam, L. Bosche, L. Castaneda-Losada, M. Winkler, U.-P. Apfel, T. Happe |
Sunlight dependent hydrogen production by photosensitizer - hydrogenase systems |
ChemSusChem 10 (2017) 894-902 |
|
Research Area: B
|
|
L. Kertess, W. Lubitz, O. Ruediger, A. Adamska, P. Rodriguez, T. Happe |
Influence of the [4Fe-4S] Cluster Coordinating Cysteines on Active Site Maturation and Catalytic Properties of C. reinhardtii [FeFe]-Hydrogenase |
Chem. Sci. 8 (2017) 8127-8137 |
|
Research Area: B
|
|
L. Kertess, F. Wittkamp, C. Sommer, J. Esselborn, O. Ruediger, E. J. Reijerse, E. Hofmann, W. Lubitz, M. Winkler, T. Happe, U.-P. Apfel |
Chalcogenide substitution in the [2Fe] cluster of [FeFe]-hydrogenases conserves high enzymatic activity |
Dalton Trans. 46 (2017) 16947-16958 |
|
Research Area: B
|
|
D. Leicht, M. Kaufmann, N. Pal, G. Schwaab, M. Havenith |
From the tunneling dimer to the onset of microsolvation: Infrared spectroscopy of allyl radical water aggregates in helium nanodroplets |
J. Chem. Phys. 146 (2017) 114306 |
|
Research Area: A
|
|
D. Mani, T. Fischer, R. Schwan, A. Dey, B. Redlich, A. F. G. van der Meer, G. Schwaab, M. Havenith |
A helium nanodroplet setup for mid and far-infrared spectroscopy using pulsed-free-electron lasers: vibrational spectra of propargyl alcohol |
RSC Adv. 7 (2017) 54318-54325 |
|
Research Area: A
|
|
K. Aoki, J. Savolainen, M. Havenith |
Broadband terahertz pulse generation by optical rectification in GaP crystals |
Appl. Phys. Lett. 110 (2017) 201103 |
|
Research Area: A
|
|
F. Boehm, G. Schwaab, M. Havenith |
Mapping hydration water around alcohol chains by THz calorimetry / Kartierung des Hydratwassers um Alkoholketten mittels THz-Kalorimetrie |
Angew. Chem. Int. Ed. 56 (2017) 9981-0085 |
|
Research Area: A
|
|
V. C. Nibali, G. Morra, M. Havenith, G. Colombo |
Role of Terahertz (THz) Fluctuations in the Allosteric Properties of the PDZ Domains |
J. Phys. Chem. B 121 (2017) 10200-10208 |
|
Research Area: B
|
|
E. Feresin, M. Havenith |
Solvatationsforschung ermittelt Rolle des Solvens: das Loesungsmittel im Fokus |
Chemie Unserer Zeit 51 (2017) 18-24 |
|
Research Area: A
|
|
F. Sebastiani, S. L. P. Wolf, B. Born, T. Q. Luong, H. Coelfen, D. Gebauer, M. Havenith |
Water Dynamics from THz Spectroscopy Reveal the Locus of a Liquid-Liquid Binodal Limit in Aqueous CaCO3 Solutions / THz-Spektroskopie erlaubt Rueckschluesse auf die Wasserdynamik und die Lage einer fluessig-fluessig-binodalen Grenze in waessrigen CaCO3-Loesungen |
Angew. Chem. Int. Ed. 56 (2017) 490-495 |
|
Research Area: A
|
|
E. Decaneto, T. Vasilevskaya, Y. Kutin, H. Ogata, M. Grossman, I. Sagi, M. Havenith, W. Lubitz, W. Thiel, N. Cox |
Solvent water interactions within the active site of the membrane type I matrix metalloproteinase |
Phys. Chem. Chem. Phys. 19 (2017) 30316-30331 |
|
Research Area: B
|
|
P. Schienbein, G. Schwaab, H. Forbert, M. Havenith, D. Marx |
Correlations in the Solute-Solvent Dynamics Reach Beyond the First Hydration Shell of Ions |
J. Phys. Chem. Lett. 8 (2017) 2373-2380 |
|
Research Area: A
|
|
K. Sommer, M. Havenith |
Loesungsmittel im Fokus der Forschung |
Chemie Unserer Zeit 51 (2017) 3 |
|
Research Area: A-C
|
|
M. J. DiTucci, F. Boehm, G. Schwaab, E. R. Williams, M. Havenith |
Effects of multivalent hexacyanoferrates and their ion pairs on water molecule dynamics measured with terahertz spectroscopy |
Phys. Chem. Chem. Phys. 19 (2017) 7297-7306 |
|
Research Area: A
|
|
S. Shydlovskyi, A. Y. Zienert, S. Ince, C. Dovengerds, A. Hohendahl, J. M. Dargazanli, A. Blum, S. D. Gunther, N. Kladt, M. Sturzl, A. C. Schauss, M. Kutsch, A. Roux, G. J. K. Praefcke, C. Herrmann |
Nucleotide-dependent farnesyl switch orchestrates polymerization and membrane binding of human guanylate-binding protein 1 |
Proc. Natl. Acad. Sci. U.S.A. 114 (2017) E5559-E5568 |
|
Research Area: B
|
|
D. Russo, A. Filabozzi, A. Laloni, M. Heyden |
Pressure effects on collective density fluctuations in water and protein solutions |
Proc. Natl. Acad. Sci. U.S.A. 114 (2017) 11410-11415 |
|
Research Area: B
|
|
M. Heyden, S. Ebbinghaus, R. Winter |
Das Innere der Zelle: Ein komplexes Loesungsmittel |
Chemie Unserer Zeit 51 (2017) 26-33 |
|
Research Area: B
|
|
R. Barnes, S. Sun, Y. Fichou, F. Dahlquist, M. Heyden, S. Han |
Spatially heterogeneous surface water diffusivity around structured protein surfaces at equilibrium |
J. Am. Chem. Soc. 139 (2017) 17890-17901 |
|
Research Area: B
|
|
R. Persson, V. Pattni, A. Singh, S. M. Kast, M. Heyden |
Signatures of solvation thermodynamics in spectra of intermolecular vibrations |
J. Chem. Theory Comput. 13 (2017) 4467-4481 |
|
Research Area: B
|
|
P. Wonner, L. Vogel, F. Kneip, S. M. Huber |
Catalytic Carbon-Chlorine Bond Activation by Selenium-Based Chalcogen Bond Donors |
Chem. Eur. J. 23 (2017) 16972-16975 |
|
Research Area: A
|
|
D. Bulfield, S. M. Huber |
Synthesis of Polyflourinated Biphenyls, Pushing the Boundaries of Suzuki?Miyaura Cross Coupling with Electron-Poor Substrates |
J. Org. Chem. 82 (2017) 13188-13203 |
|
Research Area: A
|
|
G. Q. Du, F. La Mantia |
Coupling the Charging Current and the Electron-Transfer Process: The Effect on Impedance Spectra |
ChemElectroChem 4 (2017) 122-129 |
|
Research Area: C
|
|
E. Ventosa, E. Madej, G. Zampardi, B. Mei, P. Weide, H. Antoni, F. La Mantia, M. Muhler, W. Schuhmann |
Solid Electrolyte Interphase (SEI) at TiO2 Electrodes in Li-Ion Batteries: Defining Apparent and Effective SEI Based on Evidence from X-ray Photoemission Spectroscopy and Scanning Electrochemical Microscopy |
ACS Appl. Mater. Interfaces 9 (2017) 3123-3130 |
|
Research Area: C
|
|
S. Lee, P. S. J. Kaib, B. List |
N-Triflylphosphorimidoyl Trichloride: A Versatile Reagent for the Synthesis of Strong Chiral Bronsted Acids |
Synlett 28 (2017) 1478-1480 |
|
Research Area: A
|
|
P. Rodriguez-Macia, J.A. Birrell, W. Lubitz, O. Ruediger |
Electrochemical Investigations on the Inactivation of the [FeFe]-Hydrogenase from Desulfovibrio desulfuricans by O2 or Light under Hydrogen Producing Conditions |
ChemPlusChem 82 (2017) 540-545 |
|
Research Area: B
|
|
P. Rodriguez-Macia, K. Pawlak, O. Ruediger, E. Reijerse, W. Lubitz, J. A. Birrell |
Inter-cluster redox coupling influences protonation at the H-cluster in [FeFe] hydrogenases |
J. Am. Chem. Soc. 139 (2017) 15122-15134 |
|
Research Area: B
|
|
A. Nalepa, M. Malferrari, W. Lubitz, G. Venturoli, K. Moebius, A. Savitsky |
Local water sensing: water exchange in bacterial photosynthetic reaction centers embedded in a trehalose glass studied by multiresonance EPR |
Phys. Chem. Chem. Phys. 19 (2017) 28388-28400 |
|
Research Area: B
|
|
P. Rodriguez-Macia, E. Reijerse, W. Lubitz, J. A. Birrell, O. Ruediger |
Spectroscopic Evidence of Reversible Disassembly of the FeFe Hydrogenase Active Site |
J. Phys. Chem. Lett. 8 (2017) 3834-3839 |
|
Research Area: B
|
|
E. Decaneto, W. Lubitz, H. Ogata |
Structural studies of matrix metalloproteinase by X-ray diffraction |
Methods Mol. Biol. 1579 (2017) 49-60 |
|
Research Area: B
|
|
N. Cox, A. Nalepa, W. Lubitz, A. Savitsky |
ELDOR-detected NMR: A general and robust method for electron-nuclear hyperfine spectroscopy? |
J. Magn. Reson. 280 (2017) 63-78 |
|
Research Area: B
|
|
G. Mane, J. Akilavasan, E. Passas-Lagos, F. Marlow |
Site-selective TiO2 coating on asymmetric patchy particles |
Langmuir 33 (2017) 10561-10567 |
|
Research Area: C
|
|
M. Muldarisnur, F. Marlow |
Spectroscopic Investigation of Opal Formation from Suspensions |
J. Phys. Chem. B 121 (2017) 18274-18279 |
|
Research Area: A
|
|
R. Perez de Tudela, D. Marx |
Acid Dissociation in HCl-Water Clusters is Temperature Dependent and Cannot be Detected Based on Dipole Moments |
Phys. Rev. Lett. 119 (2017) 223001 |
|
Research Area: A
|
|
J. Frenzel, B. Meyer, D. Marx |
Bicanonical ab Initio Molecular Dynamics for Open Systems |
J. Chem. Theory Comput. 13 (2017) 3455-3469 |
|
Research Area: A
|
|
D. Munoz-Santiburcio, D. Marx |
Chemistry in nanoconfined water |
Chem. Sci. 8 (2017) 3444-3452 |
|
Research Area: C
|
|
C. Drechsel-Grau, D. Marx |
Collective proton transfer in ordinary ice: local environments, temperature dependence and deuteration effects |
Phys. Chem. Chem. Phys. 19 (2017) 2623-2635 |
|
Research Area: A
|
|
D. Kuchenbecker, F. Uhl, H. Forbert, G. Jansen, D. Marx |
Constructing accurate interaction potentials to describe the microsolvation of protonated methane by helium atoms |
Phys. Chem. Chem. Phys. 19 (2017) 8307-8321 |
|
Research Area: A
|
|
D. Munoz-Santiburcio, D. Marx |
Nanoconfinement in Slit Pores Enhances Water Self-Dissociation |
Phys. Rev. Lett. 119 (2017) 056002 |
|
Research Area: A
|
|
R. Tripathi, R. Glaves, D. Marx |
The GTPase hGBP1 converts GTP to GMP in two steps via proton shuttle mechanisms |
Chem. Sci. 8 (2017) 371-380 |
|
Research Area: B
|
|
P. Dopieralski, J. Ribas-Arino, P. Anjukandi, M. Krupicka, D. Marx |
Unexpected mechanochemical complexity in the mechanistic scenarios of disulfide bond reduction in alkaline solution |
Nat. Chem. 9 (2017) 164-170 |
|
Research Area: A
|
|
A. Esser, S. Belsare, D. Marx, T. Head-Gordon |
Mode Specific THz Spectra of Solvated Amino Acids using the AMOEBA Polarizable Force Field |
Phys. Chem. Chem. Phys. 19 (2017) 5579-5590 |
|
Research Area: B
|
|
D. P. Demarque, C. Merten |
Intra- vs. intermolecular hydrogen bonding: Solvent-dependent conformational preferences of a common supramolecular binding motif from 1H-NMR and VCD spectra |
Chem. Eur. J. 19 (2017) 1795-17922 |
|
Research Area: A
|
|
G. Chianese, J. Silber, P. Luciano, C. Merten, D. Erpenbeck, B. Topaloglu, M. Kaiser, D. Tasdemir |
Antiprotozoal Linear Furanosesterterpenoids from the Marine Sponge Ircinia oros |
J. Nat. Prod. 80 (2017) 2566-2571 |
|
Research Area: A
|
|
L. M. Schneider, V. M. Schmiedel, T. Pecchioli, D. Lentz, C. Merten, M. Christmann |
Asymmetric Synthesis of Carbocyclic Propellanes |
Org. Lett. 19 (2017) 2310-2313 |
|
Research Area: A
|
|
V. Smyrniotopoulos, C. Merten, M. Kaiser, D. Tasdemir |
Bifurcatriol, a New Antiprotozoal Acyclic Diterpene from the Brown Alga Bifurcaria bifurcata |
Mar. Drugs 15 (2017) 245 |
|
Research Area: A
|
|
Z. J. Jia, C. Merten, L. Knauer, S. Murarka, C. Strohmann, H. Waldmann |
Biology-Oriented Synthesis of Decahydro-4,8-epoxyazulene Scaffolds |
Synlett 28 (2017) 2918-2922 |
|
Research Area: A
|
|
C. H. Pollok, Q. Zhang, K. Tiefenbacher, C. Merten |
Chirality Induction from a Chiral Guest to the Hydrogen-Bonding Network of Its Hexameric Resorcinarene Host Capsule |
ChemPhysChem 18 (2017) 1987-1991 |
|
Research Area: A
|
|
Z.-J. Jia, C. Merten, R. Gontla, C. G. Daniliuc, A. P. Antonchick, H. Waldmann |
General Enantioselective C-H Activation with Efficiently Tunable Cyclopentadienyl Ligands |
Angew. Chem. Int. Ed. 56 (2017) 2429-2434 |
|
Research Area: A
|
|
C. H. Pollok, T. Riesebeck, C. Merten |
Photoisomerization of a chiral imine molecular switch followed by matrix-isolation VCD spectroscopy |
Angew. Chem. Int. Ed. 56 (2017) 1925-1928 |
|
Research Area: A
|
|
K. Buennemann, C. Merten |
Solvation of a chiral carboxylic acid: effects of hydrogen bonding on the IR and VCD spectra of alpha-methoxyphenylacetic acid |
Phys. Chem. Chem. Phys. 19 (2017) 18948-18956 |
|
Research Area: A
|
|
C. Merten |
Vibrational optical activity as probe for intermolecular interactions |
Phys. Chem. Chem. Phys. 19 (2017) 18803-18812 |
|
Research Area: A
|
|
N. Berger, F. Li, B. Mallick, J. T. Brueggemann, W. Sander, C. Merten |
Solution and solid state conformational preferences of a family of cyclic disulphide bridged tetrapeptides |
Biopolymers 107 (2017) 28-34 |
|
Research Area: A
|
|
C. Merten, M. Dirkmann, F. Schulz |
Stereochemical assignment of fusiccocadiene from NMR shielding constants and vibrational circular dichroism spectroscopy |
Chirality 29 (2017) 409-414 |
|
Research Area: A
|
|
K. Boom, F. Stein, S. Ernst, K. Morgenstern |
Coverage-Induced Conformational Selectivity |
J. Phys. Chem. C 121 (2017) 20254-20258 |
|
Research Area: C
|
|
K. Morgenstern |
Hydratisierung von und auf Oberflaechen |
Chemie Unserer Zeit 51 (2017) 44-50 |
|
Research Area: C
|
|
W. Dong, W. Xia, K. P. Xie, B. X. Peng, M. Muhler |
Synergistic effect of potassium hydroxide and steam co-treatment on the functionalization of carbon nanotubes applied as basic support in the Pd-catalyzed liquid-phase oxidation of ethanol |
Carbon 121 (2017) 452-462 |
|
Research Area: C
|
|
C. Roesler, S. Dissegna, V. L. Rechac, M. Kauer, P. Guo, S. Turner, K. Ollegott, H. Kobayashi, T. Yamamoto, D. Peeters, Y. Wang, S. Matsumura, G. Van Tendeloo, H. Kitagawa, M. Muhler, F. X. Llabres i Xamena, R. A. Fischer |
Encapsulation of Bimetallic Metal Nanoparticles into Robust Zirconium-Based Metal-Organic Frameworks: Evaluation of the Catalytic Potential for Size-Selective Hydrogenation |
Chem. Eur. J. 23 (2017) 3583-3594 |
|
Research Area: C
|
|
J. Masa, I. Sinev, H. Mistry, E. Ventosa, M. de la Mata, J. Arbiol, M. Muhler, B. Roldan Cuenya, W. Schuhmann |
Ultrathin High Surface Area Nickel Boride (NixB) Nanosheets as Highly Efficient Electrocatalyst for Oxygen Evolution |
Adv. Energy Mater. 7 (2017) 1700381 |
|
Research Area: C
|
|
D. Hiltrop, J. Masa, A. Botz, A. Lindner, W. Schuhmann, M. Muhler |
Micrometer-precise determination of the thin electrolyte layer of a spectroelectrochemical cell by microelectrode approach curves |
Anal. Chem. 89 (2017) 4367-4372 |
|
Research Area: C
|
|
Y. Guo, K. Sivalingam, E. F. Valeev, F. Neese |
Explicitly correlated N-electron valence state perturbation theory (NEVPT2-F12) |
J. Chem. Phys. 147 (2017) 064110 |
|
Research Area: A
|
|
M. Sparta, M. Retegan, P. Pinski, C. Riplinger, U. Becker, F. Neese |
Multilevel Approaches within the Local Pair Natural Orbital Framework |
J. Chem. Theory Comput. 13 (2017) 3198-3207 |
|
Research Area: A
|
|
F. Pavosevic, C. Peng, P. Pinski, C. Riplinger, F. Neese, E. F. Valeev |
SparseMaps-A systematic infrastructure for reduced scaling electronic structure methods. V. Linear scaling explicitly correlated coupled-cluster method with pair natural orbitals |
J. Chem. Phys. 146 (2017) 174108 |
|
Research Area: A
|
|
T. Lohmiller, V. Krewald, A. Sedoud, A. W. Rutherford, F. Neese, W. Lubitz, D. A. Pantazis, N. Cox |
The First State in the Catalytic Cycle of the Water-Oxidizing Enzyme: Identification of a Water-Derived micro-Hydroxo Bridge |
J. Am. Chem. Soc. 139 (2017) 14412-14424 |
|
Research Area: B
|
|
I. Zegkinoglou, A. Zendegani, I. Sinev, S. Kunze, H. Mistry, H. S. Jeon, J. Zhao, M. Y. Hu, E. E. Alp, S. Piontek, M. Smialkowski, U. P. Apfel, F. Koermann, J. Neugebauer, T. Hickel, B. Roldan Cuenya |
Operando phonon studies of the protonation mechanism in highly active hydrogen evolution reaction pentlandite catalysts |
J. Am. Chem. Soc. 139 (2017) 14360-14363 |
|
Research Area: C
|
|
D. Siegmund, N. Lorenz, Y. Gothe, C. Spies, B. Geissler, P. Prochnow, P. Nuernberger, J. E. Bandow, N. Metzler-Nolte |
Benzannulated Re(I)-NHC complexes: synthesis, photophysical properties and?antimicrobial activity? |
Dalton Trans. 46 (2017) 15269-15279 |
|
Research Area: B
|
|
C. G. Norton, M. Petermann, T. Fieback |
Universal Electromagnetic Suspension Balance with nanogramme mass resolution for measurement of sorption on small samples in top and bottom loading configurations |
Meas. Sci. Technol. 28 (2017) 55903 |
|
Research Area: C
|
|
O. Melchaeva, P. Voyame, V. Costa Bassetto, M. Prokein, M. Renner, E. Weidner, M. Petermann, A. Battistel |
Electrochemical Reduction of Protic Supercritical CO2 on Copper Electrodes |
ChemSusChem 10 (2017) 3660-3670 |
|
Research Area: C
|
|
X. Du, L. Li, F. B. Sadabad, A. Welle, J. Li, S. Heissler, H. Zhang, N. Plumere, P. A. Levkin |
Bio-inspired Strategy for Controlled Dopamine Polymerization in Basic Solutions |
Polym. Chem. 8 (2017) 2145-2151 |
|
Research Area: B
|
|
H. J. Zhang, T. Oellers, W. Q. Feng, T. Abdulazim, E. N. Saw, A. Ludwig, P. A. Levkin, N. Plumere |
High-Density Droplet Microarray of Individually Addressable Electrochemical Cells |
Anal. Chem. 89 (2017) 5832-5839 |
|
Research Area: C
|
|
F. Zhao, N. Plumere, M. M. Nowaczyk, A. Ruff, W. Schuhmann, F. Conzuelo |
Interrogation of a PS1-Based Photocathode by Means of Scanning Photoelectrochemical Microscopy |
Small 13 (2017) 1604093 |
|
Research Area: C
|
|
A. Ruff, J. Szczesny, S. Zacarias, I. A. C. Pereira, N. Plumere, W. Schuhmann |
Protection and Reactivation of the NiFeSe Hydrogenase from Desulfovibrio vulgaris Hildenborough under Oxidative Conditions |
ACS Energy Lett. 2 (2017) 964-968 |
|
Research Area: C
|
|
M. A. Ben Souissi, R. Kleinrahm, X. Yang, M. Richter |
Vapor-Phase (p, rho, T, x) Behavior and Virial Coefficients for the Binary Mixture (0.05 Hydrogen+0.95 Carbon Dioxide) over the Temperature Range from (273.15 to 323.15) K with Pressures up to 6 MPa |
J. Chem. Eng. Data 62 (2017) 2973-2981 |
|
Research Area: A
|
|
F. Y. Zhao, F. Conzuelo, V. Hartmann, H. G. Li, S. Stapf, M. M. Nowaczyk, M. Roegner, N. Plumere, W. Lubitz, W. Schuhmann |
A novel versatile microbiosensor for local hydrogen detection by means of scanning photoelectrochemical microscopy |
Biosens. Bioelectron. 94 (2017) 433-437 |
|
Research Area: B,C
|
|
H. Mistry, Y. W. Choi, A. Bagger, F. Scholten, C. S. Bonifacio, I. Sinev, N. J. Divins, I. Zegkinoglou, H. S. Jeon, K. Kisslinger, E. A. Stach, J. C. Yang, J. Rossmeisl, B. Roldan Cuenya |
Enhanced Carbon Dioxide Electroreduction to Carbon Monoxide over Defect-Rich Plasma-Activated Silver Catalysts |
Angew. Chem. Int. Ed. 56 (2017) 11394-11398 |
|
Research Area: C
|
|
D. F. Gao, F. Sohoken, B. Roldan Cuenya |
Improved CO2 Electroreduction Performance on Plasma-Activated Cu Catalysts via Electrolyte Design: Halide Effect |
ACS Catal. 7 (2017) 5112-5120 |
|
Research Area: C
|
|
Y. Choi, H. Mistry, B. Roldan Cuenya |
New insights into working nanostructured electrocatalysts through operando spectroscopy and microscopy |
Curr. Opin. Electrochem. 1 (2017) 95-103 |
|
Research Area: C
|
|
D. Gao, I. Zegkinoglou, N. J. Divins, F. Scholten, I. Sinev, P. Grosse, B. Roldan Cuenya |
Plasma-activated Copper Nanocube Catalysts for Efficient Carbon Dioxide Electroreduction to Hydrocarbons and Alcohols |
ACS Nano 11 (2017) 4825-4831 |
|
Research Area: C
|
|
H. Mistry, R. Reske, P. Strasser, B. Roldan Cuenya |
Size-dependent reactivity of gold-copper bimetallic nanoparticles during CO2 electroreduction |
Catal. Today 288 (2017) 30-36 |
|
Research Area: C
|
|
W. Ju, A. Bagger, G. P. Hao, A. Varela, I. Sinev, V. Bon, B. Roldan Cuenya, S. Kaskel, J. Rossmeisl, P. Strasser |
Understanding activity and selectivity of metal-nitrogen-doped carbon catalysts for electrochemical reduction of CO2 |
Nat. Commun. 8 (2017) 944 |
|
Research Area: C
|
|
V. Jakobi, P. Salmen, M. Paulus, M. Tolan, A. Rosenhahn |
Compositional fingerprint of soy sauces via hydrophobic surface interaction |
Food Chem. 218 (2017) 256-260 |
|
Research Area: C
|
|
E. Altuntepe, A. Reinhardt, J. Brinkmann, T. Briesemann, G. Sadowski, C. Held |
Phase behaviour of binary mixtures containing succinic acid or its esters |
J. Chem. Eng. Data 62 (2017) 1983-1993 |
|
Research Area: A
|
|
R. I. Canales, C. Held, M. J. Lubben, J. F. Brennecke, G. Sadowski |
Predicting the Solubility of CO2 in Toluene plus Ionic Liquid Mixtures with PC-SAFT |
Ind. Eng. Chem. Res. 56 (2017) 9885-9894 |
|
Research Area: A
|
|
M. Voges, R. Abu, M. T. Gundersen, C. Held, J. M. Woodley, G. Sadowski |
Reaction Equilibrium of the omega-Transamination of (S)-Phenylethylamine: Experiments and ePC-SAFT Modeling |
Org. Process Res. Dev. 21 (2017) 976-986 |
|
Research Area: A
|
|
E. Altuntepe, T. Greinert, F. Hartmann, A. Reinhardt, G. Sadowski, C. Held |
Thermodynamics of enzyme-catalyzed esterifications: I. Succinic acid esterification with ethanol |
Appl. Microbiol. Biotechnol. 101 (2017) 5973-5984 |
|
Research Area: A
|
|
E. Altuntepe, V. N. Emelyanenko, M. Forster-Rotgers, G. Sadowski, S. P. Verevkin, C. Held |
Thermodynamics of enzyme-catalyzed esterifications: II. Levulinic acid esterification with short-chain alcohols |
Appl. Microbiol. Biotechnol. 101 (2017) 7509-7521 |
|
Research Area: A
|
|
M. Gao, C. Held, S. Patra, L. Arns, G. Sadowski, R. Winter |
Crowders and Cosolvents - Major Contributors to the Cellular Milieu and Efficient Means to Counteract Environmental Stresses |
ChemPhysChem 18 (2017) 2951-2972 |
|
Research Area: B
|
|
A. Sprengel, P. Lill, P. Stegemann, K. Bravo-Rodriguez, E. C. Schoeneweiss, M. Merdanovic, D. Gudnason, M. Aznauryan, L. Gamrad, S. Barcikowski, E. Sanchez-Garcia, V. Birkedal, C. Gatsogiannis, M. Ehrmann, B. Sacca |
Tailored protein encapsulation into a DNA host using geometrically organized supramolecular interactions |
Nat. Commun. 8 (2017) 14472 |
|
Research Area: B
|
|
D. Bier, S. Mittal, K. Bravo-Rodriguez, A. Sowislok, X. Guillory, J. Briels, C. Heid, M. Bartel, B. Wettig, L. Brunsveld, E. Sanchez-Garcia, T. Schrader, C. Ottmann |
The Molecular Tweezer CLR01 Stabilizes a Disordered Protein-Protein-Interface |
J. Am. Chem. Soc. 139 (2017) 16256-16263 |
|
Research Area: B
|
|
T. Voepel, K. Bravo-Rodriguez, S. Mittal, S. Vachharajani, A. Sharma, A. Steinhof, F.G. Klaerner, T. Schrader, G. Bitan, E.E. Wanker, S. Ebbinghaus, E. Sanchez-Garcia |
Inhibition of Huntingtin exon-1 aggregation by the molecular tweezer CLR01 |
J. Am. Chem. Soc 139 (2017) 5640-5643 |
|
Research Area: B
|
|
Y. A. Tsegaw, P. E. Kadam, N. Toetsch, E. Sanchez-Garcia, W. Sander |
Is Magnetic Bistability of Carbenes a General Phenomenon? Isolation of Simple Aryl(trifluoromethyl)carbenes in Both Their Singlet and Triplet States |
J. Am. Chem. Soc. 139 (2017) 12310-12316 |
|
Research Area: A
|
|
P. Costa, J. Mieres-Perez, N. Oezkan, W. Sander |
Activation of the B@F Bond by Diphenylcarbene: A Reversible 1,2-Fluorine Migration between Boron and Carbon |
Angew. Chem. Int. Ed. 56 (2017) 1760-1764 |
|
Research Area: A
|
|
F. Borget, S. Mueller, D. Grote, P. Theule, V. Vinogradoff, T. Chiavassa, W. Sander |
CN radical hydrogenation from solid H2 reactions, an alternative way of HCN formation in the interstellar medium |
Astron. Astrophys. 598 (2017) A22 |
|
Research Area: A
|
|
P. Costa, I. Trosien, J. Mieres-Perez, W. Sander |
Isolation of an Antiaromatic Singlet Cyclopentadienyl Zwitterion |
J. Am. Chem. Soc. 139 (2017) 13024-13030 |
|
Research Area: A
|
|
T. Schleif, J. Mieres-Perez, S. Henkel, M. Ertelt, W. T. Borden, W. Sander |
The Cope Rearrangement of 1,5-Dimethylsemibullvalene-2(4)-d(1): Experimental Evidence for Heavy-Atom Tunneling |
Angew. Chem. Int. Ed. 56 (2017) 10746-10749 |
|
Research Area: A
|
|
A. Mardyukov, Y. A. Tsegaw, W. Sander, P. R. Schreiner |
The phenylselenyl radical and ist reaction with molecular oxygen |
Phys. Chem. Chem. Phys 19 (2017) 27384-27388 |
|
Research Area: A
|
|
S. Radhakrishnan, J. Mieres-Perez, M. S. Gudipati, W. Sander |
Photoinduced Reversible Electron Transfer Between the Benzhydryl Radical and Benzhydryl Cation in Amorphous Water-Ice |
J. Phys. Chem. A 121 (2017) 6405-6412 |
|
Research Area: A
|
|
Y. A. Tsegaw, S. Gobi, M. Foerstel, P. Maksyutenko, W. Sander, R. I. Kaiser |
Formation of Hydroxylamine in Low-Temperature Interstellar Model Ices |
J. Phys. Chem. A 121 (2017) 7477-7493 |
|
Research Area: A
|
|
J. Knorr, P. Sokkar, P. Costa, W. Sander, E. Sanchez-Garcia, P. Nuernberger |
Loesungsmittelmolekuele als Reaktionshelfer |
Nachrichten aus der Chemie 65 (2017) 992-996 |
|
Research Area: A
|
|
K. Keller, V. Mertens, M. Qi, A. I. Nalepa, A. Godt, A. Savitsky, G. Jeschke, M. Yulikov |
Computing distance distributions from dipolar evolution data with overtones: RIDME spectroscopy with Gd(III)-based spin labels |
Phys. Chem. Chem. Phys. 19 (2017) 17856-17876 |
|
Research Area: A
|
|
W. T. S. Cole, R. J. Saykally |
Hydrogen bond network rearrangement dynamics in water clusters: Effects of intermolecular vibrational excitation on tunneling rates |
J. Chem. Phys. 147 (2017) 064301 |
|
Research Area: A
|
|
J. W. Smith, R. J. Saykally |
Soft X-ray Absorption Spectroscopy of Liquids and Solutions |
Chem. Rev. 117 (2017) 13909-13934 |
|
Research Area: A
|
|
J. Michalowsky, L. V. Schaefer, C. Holm, J. Smiatek |
A Refined Polarizable Water Model for the Coarse-Grained MARTINI Force Field with Long-Range Electrostatic Interactions |
J. Chem. Phys. 146 (2017) 054501 |
|
Research Area: B
|
|
P. Garidel, A. B. Kuhn, L. V. Schaefer, A. R. Karow-Zwick, M. Blech |
High-concentration protein formulations: How high is high? |
Eur. J. Pharm. Biopharm. 119 (2017) 353-360 |
|
Research Area: B
|
|
A. B. Kuhn, S. Kube, A. R. Karow-Zwick, D. Seeliger, P. Garidel, M. Blech, L. V. Schaefer |
Improved Solution-State Properties of Monoclonal Antibodies by Targeted Mutations |
J. Phys. Chem. B 121 (2017) 10818-10827 |
|
Research Area: B
|
|
O. Fisette, S. Wingbermuehle, L. V. Schaefer |
Partial Dissociation of Truncated Peptides Influences the Structural Dynamics of the MHC I Binding Groove |
Front. Immunol. 8 (2017) 408 |
|
Research Area: B
|
|
K. Reichel, O. Fisette, T. Braun, O. F. Lange, G. Hummer, L. V. Schaefer |
Systematic Evaluation of CS-Rosetta for Membrane Protein Structure Prediction with Sparse NOE Restraints |
Proteins 85 (2017) 812-826 |
|
Research Area: B
|
|
S. M. Gopal, F. Klumpers, C. Herrmann, L. V. Schaefer |
Solvent Effects on Ligand Binding to a Serine Protease |
Phys. Chem. Chem. Phys. 19 (2017) 10753-10766 |
|
Research Area: B
|
|
R. Semino, J. P. Duerholt, R. Schmid, G. Maurin |
Multiscale Modeling of the HKUST-1/Poly(vinyl alcohol) Interface: From an Atomistic to a Coarse Graining Approach |
J. Phys. Chem. C 121 (2017) 21491-21496 |
|
Research Area: C
|
|
A. C. Medina, R. Schmid |
Verlet-like algorithms for Car-Parrinello molecular dynamics with unequal electronic occupations |
J. Chem. Phys. 147 (2017) 114102 |
|
Research Area: C
|
|
F. Lopez, S. Ma, R. Ludwig, W. Schuhmann, A. Ruff |
A polymer multilayer based amperometric biosensor for the detection of lactose in the presence of high concentrations of glucose |
Electroanalysis 29 (2017) 154-161 |
|
Research Area: C
|
|
A. Ruff, P. Pinyou, M. Nolten, F. Conzuelo, W. Schuhmann |
A Self-Powered Ethanol Biosensor |
ChemElectroChem 4 (2017) 890-897 |
|
Research Area: C
|
|
V. Essmann, J. Clausmeyer, W. Schuhmann |
Alternating current-bipolar electrochemistry |
Electrochem. Commun. 75 (2017) 82-85 |
|
Research Area: C
|
|
S. Alsaoub, A. Ruff, F. Conzuelo, E. Ventosa, R. Ludwig, S. Shleev, W. Schuhmann |
An Intrinsic Self-Charging Biosupercapacitor Comprised of a High-Potential Bioanode and a Low-Potential Biocathode |
ChemPlusChem 82 (2017) 576-583 |
|
Research Area: C
|
|
F. Conzuelo, K. Sliozberg, R. Gutkowski, S. Gruetzke, M. Nebel, W. Schuhmann |
High-resolution analysis of photoanodes for water splitting by means of scanning photoelectrochemical microscopy |
Anal. Chem. 89 (2017) 1222-1228 |
|
Research Area: C
|
|
V. Essmann, F. Y. Zhao, V. Hartmann, M. M. Nowaczyk, W. Schuhmann, F. Conzuelo |
In Operando Investigation of Electrical Coupling of Photosystem 1 and Photosystem 2 by Means of Bipolar Electrochemistry |
Anal. Chem. 89 (2017) 7160-7165 |
|
Research Area: B
|
|
S. Barwe, C. Andronescu, E. Vasile, J. Masa, W. Schuhmann |
Influence of Ni to Co ratio in mixed Co and Ni phosphides on their electrocatalytic oxygen evolution activity |
Electrochem. Commun. 79 (2017) 41-45 |
|
Research Area: C
|
|
B. Konkena, J. Masa, A. J. R. Botz, I. Sinev, W. Xia, J. Kossmann, R. Drautz, M. Muhler, W. Schuhmann |
Metallic NiPS3@NiOOH Core-Shell Heterostructures as Highly Efficient and Stable Electrocatalyst for the Oxygen Evolution Reaction |
ACS Catal. 7 (2017) 229-237 |
|
Research Area: C
|
|
V. Brasiliense, J. Clausmeyer, A. L. Dauphin, J. M. Noel, P. Berto, G. Tessier, W. Schuhmann, F. Kanoufi |
Opto-electrochemical In Situ Monitoring of the Cathodic Formation of Single Cobalt Nanoparticles |
Angew. Chem. Int. Ed. 56 (2017) 10598-10601 |
|
Research Area: C
|
|
S. Barwe, J. Masa, C. Andronescu, B. Mei, W. Schuhmann, E. Ventosa |
Overcoming the instability of nanoparticle based catalyst films in alkaline electrolyzers by self-assembling and self-healing films |
Angew. Chem. Int. Ed. 56 (2017) 8573-8577 |
|
Research Area: C
|
|
S. Barwe, C. Andronescu, J. Masa, E. Ventosa, S. Klink, A. Genc, J. Arbiol, W. Schuhmann |
Polybenzoxazine-Derived N-doped Carbon as Matrix for Powder-Based Electrocatalysts |
ChemSusChem 10 (2017) 2653-2659 |
|
Research Area: C
|
|
C. Andronescu, S. Barwe, E. Ventosa, J. Masa, E. Vasile, B. Konkena, S. Moeller, W. Schuhmann |
Powder Catalyst Fixation for Post-Electrolysis Structural Characterization of NiFe Layered Double Hydroxide Based Oxygen Evolution Reaction Electrocatalysts |
Angew. Chem. Int. Ed. 56 (2017) 11258-11262 |
|
Research Area: C
|
|
S. Klink, Y. Ishige, W. Schuhmann |
Prussian blue analogues: A versatile framework for solid-contacts ion-selective electrodes with tunable potential |
ChemElectroChem 4 (2017) 490-494 |
|
Research Area: C
|
|
E. Gonzalez-Arribas, O. Aleksejeva, T. Bobrowski, M. D. Toscano, L. Gorton, W. Schuhmann |
Solar biosupercapacitor |
Electrochem. Commun. 74 (2017) 9-13 |
|
Research Area: C
|
|
E. Gonzalez-Arribas, T. Bobrowski, C. Di Bari, K. Sliozberg, R. Ludwig, M. D. Toscano, A. L. De Lacey, M. Pita, W. Schuhmann, S. Shleev |
Transparent, mediator- and membrane-free enzymatic fuel cell based on nanostructured chemically modified indium tin oxide electrodes |
Biosens. Bioelectron. 97 (2017) 46-52 |
|
Research Area: C
|
|
A. Ganassin, P. Sebastian, V. Climent, W. Schuhmann, A. S. Bandarenka, F. L. Juan |
On the pH Dependence of the Potential of Maximum Entropy of Ir(111) Electrodes |
Sci. Rep. 7 (2017) 1246 |
|
Research Area: C
|
|
A. Aijaz, J. Masa, C. Roesler, W. Xia, P. Weide, R. A. Fischer, W. Schuhmann, M. Muhler |
Metal-Organic Framework Derived Carbon Nanotube Grafted Cobalt/Carbon Polyhedra Grown on Nickel Foam: An Efficient 3D Electrode for Full Water Splitting |
ChemElectroChem 4 (2017) 188-193 |
|
Research Area: C
|
|
F. Yang, W. Xia, A. Maljusch, J. Masa, D. Hollmann, W. Schuhmann, M. Muhler |
NH3 post-treatment induces high activity of Co-based electrocatalysts supported on carbon nanotubes for the oxygen evolution reaction |
ChemElectroChem 4 (2017) 2091-2098 |
|
Research Area: C
|
|
S. Schuenemann, F. Schueth, H. Tueysuez |
Selective Glycerol Oxidation over Ordered Mesoporous Copper Aluminum Oxide Catalysts |
Catal. Sci. Technol. 7 (2017) 5614-5624 |
|
Research Area: C
|
|
C. G. Strippel, K. Sommer, T. Kohlbauer |
Forschung trifft Oeffentlichkeit - Konzeption und empirische Untersuchung der Ausstellung "Voellig losgeloest" |
Chemie Unserer Zeit 51 (2017) 58-64 |
|
Research Area: -
|
|
C. G. Strippel, L. Tomala, K. Sommer |
Klappe, die Erste - Schueler produzieren eigene Experimentiervideos |
Math. Naturwiss. Unterr. 70 (2017) 105-111 |
|
Research Area: -
|
|
A. K. Giri, E. Spohr |
Cluster formation of NaCl in bulk solutions: Arithmetic vs. geometric combination rules |
J. Mol. Liq. 228 (2017) 63-70 |
|
Research Area: A
|
|
J. Gujt, M. Bester-Rogac, E. Spohr |
Molecular dynamics study of stability and disintegration of long rod-like micelles: Dodecyltrimethylammonium chloride in solutions of hydroxybenzoates |
J. Mol. Liq. 228 (2017) 150-159 |
|
Research Area: B
|
|
A. Pougin, A. Lueken, C. Klinkhammer, D. Hiltrop, M. Kauer, K. Toelle, M. Havenith-Newen, K. Morgenstern, W. Gruenert, M. Muhler, J. Strunk |
Probing Oxide Reduction and Phase Transformations at the Au-TiO2 Interface by Vibrational Spectroscopy |
Top. Catal. 60 (2017) 1744-1753 |
|
Research Area: C
|
|
V. Pattni, T. Vasilevskaya, W. Thiel, M. Heyden |
Distinct Protein Hydration Water Species Defined by Spatially Resolved Spectra of Intermolecular Vibrations |
J. Phys. Chem. B 121 (2017) 7431-7442 |
|
Research Area: B
|
|
N. Koenig, M. Paulus, K. Julius, J. Schulze, M. Voetz, M. Tolan |
Antibodies under pressure: A Small-Angle X-ray Scattering study of Immunoglobulin G under high hydrostatic pressure |
Biophys. Chem. 231 (2017) 45-49 |
|
Research Area: B
|
|
C. Weis, C. Sternemann, V. Cerantola, C. J. Sahle, G. Spiekermann, M. Harder, Y. Forov, A. Kononov, R. Sakrowski, H. Yavas, M. Tolan, M. Wilke |
Pressure driven spin transition in siderite and magnesiosiderite single crystals |
Sci. Rep. 7 (2017) 16526 |
|
Research Area: C
|
|
F. J. Wirkert, C. Hoelzl, M. Paulus, P. Salmen, M. Tolan, D. Horinek, J. Nase |
The Hydrophobic Gap at High Hydrostatic Pressures |
Angew. Chem. Int. Ed. 56 (2017) 12958-12961 |
|
Research Area: C
|
|
F. Lehmkuehler, Y. Forov, M. Elbers, I. Steinke, C. J. Sahle, C. Weis, M. Itou, Y. Sakurai, A. Poulain, C. Sternemann |
Temperature dependence of the hydrogen bond network in Trimethylamine N-oxide and guanidine hydrochloride - water solutions |
Phys. Chem. Chem. Phys. 19 (2017) 28470-28475 |
|
Research Area: C
|
|
A. El Arrassi, P. Bellova, S. M. Javid, Y. Motemani, C. Khare, C. Sengstock, M. Koller, A. Ludwig, K. Tschulik |
A Unified Interdisciplinary Approach to Design Antibacterial Coatings for Fast Silver Release |
ChemElectroChem 4 (2017) 1975-1983 |
|
Research Area: C
|
|
G. Dodekatos, H. Tueysuez |
Effect of post-treatment on structure and catalytic activity of CuCo-based materials for glycerol oxidation |
ChemCatChem 9 (2017) 610-619 |
|
Research Area: C
|
|
X. H. Deng, S. Oztuerk, C. Weidenthaler, H. Tueysuez |
Iron-Induced Activation of Ordered Mesoporous Nickel Cobalt Oxide Electrocatalyst for the Oxygen Evolution Reaction |
ACS Appl. Mater. Interfaces 9 (2017) 21225-21233 |
|
Research Area: C
|
|
K. Chen, X. H. Deng, G. Dodekatos, H. Tueysuez |
Photocatalytic Polymerization of 3,4-Ethylenedioxythiophene over Cesium Lead Iodide Perovskite Quantum Dots |
J. Am. Chem. Soc. 139 (2017) 12267-12273 |
|
Research Area: C
|
|
K. Chen, S. Schuenemann, H. Tueysuez |
Preparation of Waterproof Organometal Halide Perovskite Photonic Crystal Beads |
Angew. Chem. Int. Ed. 129 (2017) 6648-6652 |
|
Research Area: C
|
|
X. Deng, K. Chen, H. Tueysuez |
Protocol for the Nanocasting Method: Preparation of Ordered Mesoporous Metal Oxides |
Chem. Mater. 29 (2017) 40-52 |
|
Research Area: C
|
|
X. Deng, R. Rin, J. C. Tseng, C. Weidenthaler, U. P. Apfel, H. Tueysuez |
Monodispersed mesoporous silica spheres supported Co3O4 as robust catalyst for oxygen evolution reaction |
ChemCatChem 9 (2017) 4238-4243 |
|
Research Area: C
|
|
S. Schuenemann, S. Brittman, K. Chen, E. Garnett, H. Tueysuez |
Halide perovskite 3D photonic crystals for distributed feedback lasers |
ACS Photonics 4 (2017) 2522-2528 |
|
Research Area: C
|
|
C. Schuabb, S. Pataraia, M. Berghaus, R. Winter |
Exploring the Effects of Temperature and Pressure on the Structure and Stability of a Small RNA Hairpin |
Biophys. Chem. 231 (2017) 161-166 |
|
Research Area: B
|
|
S. R. Al-Ayoubi, P. H. Schummel, M. Golub, J. Peters, R. Winter |
Influence of cosolvents, self-crowding, temperature and pressure on the sub-nanosecond dynamics and folding stability of lysozyme |
Phys. Chem. Chem. Phys. 19 (2017) 14230-14237 |
|
Research Area: B
|
|
P. H. Schummel, M. Gao, R. Winter |
Modulation of the Polymerization Kinetics of alpha/beta-Tubulin by Osmolytes and Macromolecular Crowding |
ChemPhysChem 18 (2017) 189-197 |
|
Research Area: B
|
|
M. Gao, L. Arns, R. Winter |
Modulation of the Thermodynamic Signatures of an RNA Thermometer by Osmolytes and Salts |
Angew. Chem. Int. Ed. 129 (2017) 2302-2306 |
|
Research Area: B
|
|
S. Patra, C. Anders, N. Erwin, R. Winter |
Osmolyte Effects on the Conformational Dynamics of a DNA Hairpin at Ambient and Extreme Environmental Conditions |
Angew. Chem. Int. Ed. 56 (2017) 5045-5049 |
|
Research Area: B
|
|
M. Gao, B. Harish, M. Berghaus, R. Seymen, L. Arns, S. A. McCallum, C. A. Royer, R. Winter |
Temperature and pressure limits of guanosine monophosphate self-assemblies |
Sci. Rep. 7 (2017) 9864 |
|
Research Area: B
|
|
N. Smolin, V. P. Voloshin, A. V. Anikeenko, A. Geiger, R. Winter, N. N. Medvedev |
TMAO and Urea in the Hydration Shell of the Protein SNase |
Phys. Chem. Chem. Phys. 19 (2017) 6345-6357 |
|
Research Area: B
|
|
C. Schuabb, N. Kumar, S. Pataraia, D. Marx, R. Winter |
Pressure Modulates the Self-cleavage Step of the Hairpin Ribozyme |
Nat. Commun. 8 (2017) 14661 |
|
Research Area: B
|
|
M. Senger, S. Mebs, J. Duan, F. Wittkamp, U.-P. Apfel, J. Heberle, M. Haumann, S. T. Stripp |
Stepwise isotope editing of [FeFe]-hydrogenases exposes cofactor dynamics |
Proc. Natl. Acad. Sci. U.S.A. 113 (2016) 8454-8459 |
|
Research Area: B
|
|
P. Balzerowski, K. Meister, J. Versluis, H. J. Bakker |
Heterodyne-detected sum frequency generation spectroscopy of polyacrylic acid at the air/water-interface |
Phys. Chem. Chem. Phys. 18 (2016) 2481-2487 |
|
Research Area: C
|
|
K. Meister, A. Baeumer, G. R. Szilvay, A. Paananen, H. J. Bakker |
Self-Assembly and Conformational Changes of Hydrophobin Classes at the Air-Water Interface |
J. Phys. Chem. Lett. 7 (2016) 4067-4071 |
|
Research Area: B
|
|
M. Hellstroem, J. Behler |
Concentration-Dependent Proton Transfer Mechanisms in Aqueous NaOH Solutions: From Acceptor-Driven to Donor-Driven and Back |
J. Phys. Chem. Lett. 7 (2016) 3302-3306 |
|
Research Area: A
|
|
V. Kapil , J. Behler, M. Ceriotti |
High Order Path Integrals Made Easy: A Precise Assessment of Nuclear Quantum Effects in Liquid Water and its Isotopomers |
J. Chem. Phys. 145 (2016) 234103 |
|
Research Area: C
|
|
T. Morawietz, A. Singraber, C. Dellago, J. Behler |
How Van der Waals Interactions Determine the Unique Properties of Water |
Proc. Natl. Acad. Sci. U.S.A. 113 (2016) 8368-8373 |
|
Research Area: C
|
|
S. Kondati Natarajan, J. Behler |
Neural network molecular dynamics simulations of solid-liquid interfaces: water at low-index copper surfaces |
Phys. Chem. Chem. Phys. 18 (2016) 28704-28725 |
|
Research Area: C
|
|
B. Cheng, J. Behler, M. Ceriotti |
Nuclear Quantum Effects in Water at the Triple Point: Using Theory as a Link between Experiments |
J. Phys. Chem. Lett. 7 (2016) 2210-2215 |
|
Research Area: C
|
|
J. Behler |
Perspective: Machine learning potentials for atomistic simulations |
J. Chem. Phys. 145 (2016) 170901 |
|
Research Area: A
|
|
S. Wuttge, A. Licht, M. H. Timachi, E. Bordignon, E. Schneider |
Mode of Interaction of the Signal-Transducing Protein EIIA(Glc) with the Maltose ABC Transporter in the Process of Inducer Exclusion |
Biochemistry 55 (2016) 5442-5452 |
|
Research Area: B
|
|
H. Celia, N. Noinaj, S. D. Zakharov, E. Bordignon, I. Botos, M. Santamaria, T. J. Barnard, W. A. Cramer, R. Lloubes, S. K. Buchanan |
Structural insight into the role of the Ton complex in energy transduction |
Nature 538 (2016) 60-65 |
|
Research Area: B
|
|
D. Gnutt, S. Ebbinghaus |
The macromolecular crowding effect - From in vitro into the cell |
J. Biol. Chem. 397 (2016) 37-44 |
|
Research Area: B
|
|
M. Senske, D. Constantinescu-Aruxandei, M. Havenith, C. Herrmann, H. Weingaertner, S. Ebbinghaus |
The temperature dependence of the Hofmeister series: thermodynamic fingerprints of cosolute-protein interactions |
Phys. Chem. Chem. Phys. 18 (2016) 29698-29708 |
|
Research Area: B
|
|
M. Gao, D. Gnutt, A. Orban, B. Appel, F. Righetti, R. Winter, F. Narberhaus, S. Mueller, S. Ebbinghaus |
RNA Hairpin Folding in the Crowded Cell |
Angew. Chem. Int. Ed. 55 (2016) 3224-3228 |
|
Research Area: B
|
|
S. Nayak, A. Erbe |
Mechanism of the potential-triggered surface transformation of germanium in acidic medium studied by ATR-IR spectroscopy |
Phys. Chem. Chem. Phys. 18 (2016) 25100-25109 |
|
Research Area: C
|
|
G. Genchev, C. Bosch, E. Wanzenberg, A. Erbe |
Role of molybdenum in corrosion of iron-based alloys in contact with hydrogen sulfide containing solution |
Corros. Mater. 68 (2016) 595-603 |
|
Research Area: C
|
|
K. Jayaramulu, K. K. R. Datta, C. Rosler, M. Petr, M. Otyepka, R. Zboril, R. A. Fischer |
Biomimetic Superhydrophobic/Superoleophilic Highly Fluorinated Graphene Oxide and ZIF-8 Composites for Oil-Water Separation |
Angew. Chem. Int. Ed. 55 (2016) 1178-1182 |
|
Research Area: C
|
|
I. Schwedler, S.Henke, M. T. Wharmby, Sneha R. Bajpe, A. K. Cheetham, R. A. Fischer |
Mixed-linker solid solutions of functionalized pillared-layer MOFs - adjusting structural flexibility, gas sorption, and thermal responsiveness |
Dalton Trans. 45 (2016) 4230-4241 |
|
Research Area: C
|
|
V. Stavila, C. Schneider, C. Mowry, T. R. Zeitler, J. A. Greathouse, A. L. Robinson, J. M. Denning, J. Volponi, K. Leong, W. Quan, M. Tu, R. A. Fischer, M. D. Allendorf |
Thin Film Growth of nbo MOFs and their Integration with Electroacoustic Devices |
Adv. Funct. Mater. 26 (2016) 1699-1707 |
|
Research Area: C
|
|
Y. Wu, S. Henke, G. Kieslich, I. Schwedler, M. S. Yang, D. A. X. Fraser, D. O'Hare |
Time-Resolved InSitu X-ray Diffraction Reveals Metal-Dependent Metal-Organic Framework Formation |
Angew. Chem. Int. Ed. 55 (2016) 14081-14084 |
|
Research Area: C
|
|
C. Roesler, A. Aijaz, S. Turner, M. Filippousi, A. Shahabi, W. Xia, G. Van Tendeloo, M. Muhler, R. A. Fischer |
Hollow Zn/Co Zeolitic Imidazolate Framework (ZIF) and Yolk-Shell Metal@Zn/Co ZIF Nanostructures |
Chem. Eur. J. 22 (2016) 3304-3311 |
|
Research Area: C
|
|
A. Aijaz, J. Masa, C. Rosler, W. Xia, P. Weide, A. J. R. Botz, R. A. Fischer, W. Schuhmann, M. Muhler |
Co@Co3O4 Encapsulated in Carbon Nanotube-Grafted Nitrogen-Doped Carbon Polyhedra as an Advanced Bifunctional Oxygen Electrode |
Angew. Chem. Int. Ed. 55 (2016) 4087-4091 |
|
Research Area: C
|
|
A. Pavlova, C. Y. Cheng, M. Kinnebrew, J. Lew, F. W. Dahlquist, S. Han |
Protein structural and surface water rearrangement constitute major events in the earliest aggregation stages of tau |
Proc. Natl. Acad. Sci. U.S.A. 113 (2016) E127-E136 |
|
Research Area: B
|
|
K. Y. Huang, C. N. Kingsley, R. Sheil, C. Y. Cheng, J. C. Bierma, K. W. Roskamp, D. Khago, R. W. Martin, S. Han |
Stability of Protein-Specific Hydration Shell on Crowding |
J. Am. Chem. Soc. 138 (2016) 5392-5402 |
|
Research Area: B
|
|
C. F. Megarity, J. Esselborn, S. V. Hexter, F. Wittkamp, U.-P. Apfel, T. Happe, F. A. Armstrong |
Electrochemical Investigations of the Mechanism of Assembly of the Active-Site H-Cluster of [FeFe]-Hydrogenases |
J. Am. Chem. Soc. 138 (2016) 15227-15233 |
|
Research Area: B
|
|
J. Noth, J. Esselborn, J. Gueldenhaupt, A. Bruenje, A. Sawyer, U.-P. Apfel, K. Gerwert, E. Hofmann, M. Winkler, T. Happe |
FeFe-Hydrogenase with Chalcogenide Substitutions at the H-Cluster Maintains Full H2 Evolution Activity |
Angew. Chem. Int. Ed. 55 (2016) 8396-8400 |
|
Research Area: B
|
|
J. Esselborn, N. Muraki, K. Klein, V. Engelbrecht, N. Metzler-Nolte, U.-P. Apfel, E. Hofmann, G. Kurisu, T. Happe |
A structural view of synthetic cofactor integration into [FeFe]-hydrogenases |
Chem. Sci. 7 (2016) 959-968 |
|
Research Area: B
|
|
C. M. Suomivuori, N. Winter, C. Haettig, D. Sundholm, V. Kaila |
Exploring the Light-Capturing Properties of Photosynthetic Chlorophyll Clusters Using Large-Scale Correlated Calculations |
J. Chem. Theory Comput. 12 (2016) 2644-2651 |
|
Research Area: B
|
|
L. Knake, H. Vondracek, M. Havenith |
A novel set-up to investigate the low-frequency spectra of aqueous solutions at high hydrostatic pressure |
Rev. Sci. Instrum. 87 (2016) 104101 |
|
Research Area: A
|
|
T. Fobbe, S. Markmann, F. Fobbe, N. Hekmat, H. Nong, S. Pal, P. Balzerowski, J. Savolainen, M. Havenith, A. D. Wieck, N. Jukam |
Broadband terahertz dispersion control in hybrid waveguides |
Opt. Express 24 (2016) 22319-22333 |
|
Research Area: A
|
|
N. Samanta, T. Q. Luong, D. Das Mahanta, R. K. Mitra, M. Havenith |
Effect of Short Chain Poly(ethylene glycol)s on the Hydration Structure and Dynamics around Human Serum Albumin |
Langmuir 32 (2016) 831-837 |
|
Research Area: B
|
|
P. Balzerowski, E. Bruendermann, M. Havenith |
Fabry-Perot Cavities for the Terahertz Spectral Range Based on High-Reflectivity Multilayer Mirrors |
IEEE Trans. Terahertz Sci. Technol. 6 (2016) 563-567 |
|
Research Area: A
|
|
M. Kaufmann, D. Leicht, R. Schwan, D. Mani, G. Schwaab, M. Havenith |
Helium droplet infrared spectroscopy of glycine and glycine-water aggregates |
Phys. Chem. Chem. Phys. 18 (2016) 28082-28090 |
|
Research Area: A
|
|
T. Q. Luong, Y. Xu, E. Bruendermann, D. M. Leitner, M. Havenith |
Hydrophobic collapse induces changes in the collective protein and hydration low frequency modes |
Chem. Phys. Lett. 651 (2016) 1-7 |
|
Research Area: B
|
|
A. Baeumer, J. Duman, M. Havenith |
Ice nucleation of an insect lipoprotein ice nucleator (LPIN) correlates with retardation of the hydrogen bond dynamics at the myo-inositol ring |
Phys. Chem. Chem. Phys. 18 (2016) 19318-19323 |
|
Research Area: B
|
|
D. Leicht, M. Kaufmann, G. Schwaab, M. Havenith |
Infrared spectroscopy of the helium solvated cyclopentadienyl radical in the CH stretch region |
J. Chem. Phys. 145 (2016) 74304 |
|
Research Area: A
|
|
R. Schwan, M. Kaufmann, D. Leicht, G. Schwaab, M. Havenith |
Infrared spectroscopy of the ny2 band of the water monomer and small water clusters (H2O)(n=2,3,4) in helium droplets |
Phys. Chem. Chem. Phys. 18 (2016) 24063-24069 |
|
Research Area: A
|
|
Y. Xu, A. Bauumer, K. Meister, C. G. Bischak, A. L. DeVries, D. M. Leitner, M. Havenith |
Protein-water dynamics in antifreeze protein III activity |
Chem. Phys. Lett. 647 (2016) 1-6 |
|
Research Area: B
|
|
D. Leicht, M. Kaufmann, R. Schwan, J. Schaefer, G. Schwaab, M. Havenith |
Understanding the microsolvation of radicals: Infrared spectroscopy of benzyl radical water clusters |
J. Chem. Phys. 145 (2016) 204305 |
|
Research Area: A
|
|
M. Kaufmann, D. Leicht, M. Havenith, B. M. Broderick, G. E. Douberly |
Infrared Spectroscopy of the Tropyl Radical in Helium Droplets |
J. Phys. Chem. A 120 (2016) 6768-6773 |
|
Research Area: A
|
|
F. Moeller, K. Merz, C. Herrmann, U.-P. Apfel |
Bimetallic nickel complexes for selective CO2 carbon capture and sequestration |
Dalton Trans. 45 (2016) 904-907 |
|
Research Area: A
|
|
M. Kutsch, P. Hortmann, C. Herrmann, S. Weibels, H. Weingaertner |
Dissecting ion-specific from electrostatic salt effects on amyloid fibrillation: A case study of insulin |
Biointerphases 11 (2016) 19008 |
|
Research Area: B
|
|
O. Fisette, C. Paeslack, R. Barnes, J. M. Isas, R. Langen, M. Heyden, S. Han, L. V. Schaefer |
Hydration Dynamics of a Peripheral Membrane Protein |
J. Am. Chem. Soc. 138 (2016) 11526-11535 |
|
Research Area: B
|
|
V. Prytkova, M. Heyden, D. Khago, J. A. Freites, C. T. Butts, R. W. Martin, D. J. Tobias |
Multi-Conformation Monte Carlo: A Method for Introducing Flexibility in Efficient Simulations of Many-Protein Systems |
J. Phys. Chem. B 120 (2016) 8115-8126 |
|
Research Area: B
|
|
D. Bulfield, S. M. Huber |
Halogen Bonding in Organic Synthesis and Organocatalysis |
Chem. Eur. J. 22 (2016) 14434-14450 |
|
Research Area: A
|
|
M. A. Gonzalez, R. Trocoli, I. Pavlovic, C. Barriga, F. La Mantia |
Capturing Cd(II) and Pb(II) from contaminated water sources by electro-deposition on hydrotalcite-like compounds |
Phys. Chem. Chem. Phys. 18 (2016) 1838-1845 |
|
Research Area: C
|
|
D. Leicht, T. C. Cheng, M. A. Duncan |
Infrared spectroscopy of the glyoxal radical cation: The charge dependence of internal rotation |
Chem. Phys. Lett. 643 (2016) 89-92 |
|
Research Area: A
|
|
D. C. McDonald II, D. T. Mauney, D. Leicht, J. H. Marks, J. A. Tan, J.-L. Kuo, M. A. Duncan |
Trapping a proton in argon: Spectroscopy and theory of the proton-bound argon dimer and its solvation |
J. Chem. Phys. 145 (2016) 231101 |
|
Research Area: A
|
|
Z. P. Zhang, H. Y. Bae, J. Guin, C. Rabalakos, M. van Gemmeren, M. Leutzsch, M. Klussmann, B. List |
Asymmetric counteranion-directed Lewis acid organocatalysis for the scalable cyanosilylation of aldehydes |
Nat. Commun. 7 (2016) 12478 |
|
Research Area: C
|
|
T. Gatzenmeier, M. van Gemmeren, Y. W. Xie, D. Hofler, M. Leutzsch, B. List |
Asymmetric Lewis acid organocatalysis of the Diels-Alder reaction by a silylated C-H acid |
Science 351 (2016) 949-952 |
|
Research Area: A
|
|
P. Rodriguez-Macia, N. Priyadarshani, A. Dutta, C. Weidenthaler, W. Lubitz, W. J. Shaw, O. Ruediger |
Covalent Attachment of the Water-insoluble Ni((P2N2Phe)-N-Cy)(2) Electrocatalyst to Electrodes Showing Reversible Catalysis in Aqueous Solution |
Electroanalysis 28 (2016) 2452-2458 |
|
Research Area: C
|
|
Y. Kutin, V. Srinivas, M. Fritz, R. Kositzki, H. S. Shafaat, J. Birrell, E. Bill, M. Haumann, W. Lubitz, M. Hoegbom, J. J. Griese, N. Cox |
Divergent Assembly Mechanisms of the Manganese/Iron Cofactors in R2lox and R2c Proteins |
J. Inorg. Biochem. 162 (2016) 164-177 |
|
Research Area: B
|
|
C. He, H. Ogata, W. Lubitz |
Elucidation of the Heme Active Site Electronic Structure Affecting the Unprecedented Nitrite Dismutase Activity of the Ferriheme b Proteins, the Nitrophorins |
Chem. Sci. 7 (2016) 5332-5340 |
|
Research Area: B
|
|
K. Keller, M. Zalibera, M. Qi, V. Koch, J. Wegner, H. Hintz, A. Godt, G. Jeschke, A. Savitsky, M. Yulikov |
EPR characterization of Mn(II) complexes for distance determination with pulsed dipolar spectroscopy |
Phys. Chem. Chem. Phys. 18 (2016) 25120-25135 |
|
Research Area: B
|
|
K. Moebius, A. Savitsky, W. Lubitz, M. Plato |
Moebius-Hueckel Topology Switching in Expanded Porphyrins: EPR, ENDOR, and DFT Studies of Doublet and Triplet Open-Shell Systems |
Appl. Magn. Reson. 47 (2016) 757-780 |
|
Research Area: A
|
|
T. Lohmiller, M. A. Vibhute, W. Lubitz, A. Savitsky |
Multifrequency Multiresonance EPR Investigation of Halogen-Bonded Complexes Involving Neutral Nitroxide Radicals |
Z. Phys. Chem. (N F) 231 (2016) 867-886 |
|
Research Area: A
|
|
M. Malferrari, A. Savitsky, W. Lubitz, K. Moebius, G. Venturoli |
Protein Immobilization Capabilities of Sucrose and Trehalose Glasses: The Effect of Protein/Sugar Concentration Unraveled by High-Field EPR |
J. Phys. Chem. Lett. 7 (2016) 4871-4877 |
|
Research Area: B
|
|
M. Malferrari, A. Savitsky, M. D. Mamedov, G. E. Milanovsky, W. Lubitz, K. Moebius, A. Y. Semenov, G. Venturoli |
Trehalose matrix effects on charge-recombination kinetics in Photosystem I of oxygenic photosynthesis at different dehydration levels |
Biochim. Biophys. Acta Bioenerg. 1857 (2016) 1440-1454 |
|
Research Area: B
|
|
M. Perez-Navarro, F. Neese, W. Lubitz, D. A. Pantazis, N. Cox |
Recent Developments in Biological Water Oxidation |
Curr. Opin. Chem. Biol. 31 (2016) 113-119 |
|
Research Area: B
|
|
V. Krewald, M. Retegan, F. Neese, W. Lubitz, D. A. Pantazis, N. Cox |
Spin State as a Marker for the Structural Evolution of Nature's Water Splitting Catalyst |
Inorg. Chem. 55 (2016) 488-501 |
|
Research Area: C
|
|
P. Costa, T. Lohmiller, I. Trosien, A. Savitsky, W. Lubitz, M. Fernandez-Oliva, E. Sanchez-Garcia, W. Sander |
Light and Temperature Control of the Spin State of Bis(p-methoxyphenyl)carbene: A Magnetically Bistable Carbene |
J. Am. Chem. Soc. 138 (2016) 1622-1629 |
|
Research Area: A
|
|
F. Marlow, M. Muldarisnur |
Colloidal Crystal Formation: Nano-Dewetting and the Assembly Process |
Proc. SPIE 9885 (2016) 98850 |
|
Research Area: C
|
|
M. Muldarisnur, F. Marlow |
Polarization angular-resolved transmission spectroscopy of opal films |
J. Nonlinear Opt. Phys. Mater. 25 (2016) 1650015 |
|
Research Area: C
|
|
M. Smiechowski, C. Schran, H. Forbert, D. Marx |
Correlated Particle Motion and THz Spectral Response of Supercritical Water |
Phys. Rev. Lett. 116 (2016) 027801 |
|
Research Area: A
|
|
P. Dopieralski, J. Ribas-Arino, P. Anjukandi, M. Krupicka, D. Marx |
Force-Induced Reversal of beta-Eliminations: Stressed Disulfide Bonds in Alkaline Solution |
Angew. Chem. Int. Ed. 55 (2016) 1304-1308 |
|
Research Area: A
|
|
D. Munoz-Santiburcio, D. Marx |
On the complex structural diffusion of proton holes in nanoconfined alkaline solutions within slit pores |
Nat. Commun. 7 (2016) 12625 |
|
Research Area: C
|
|
R. Perez de Tudela, D. Marx |
Water-Induced Zwitterionization of Glycine: Stabilization Mechanism and Spectral Signatures |
J. Phys. Chem. Lett. 7 (2016) 5137-5142 |
|
Research Area: A
|
|
F. Uhl, D. Marx, M. Ceriotti |
Accelerated path integral methods for atomistic simulations at ultra-low temperatures |
J. Chem. Phys. 145 (2016) 54101 |
|
Research Area: A
|
|
C. Hoelzl, P. Kibies, S. Imoto, R. Frach, S. Suladze, R. Winter, D. Marx, D. Horinek, S. M. Kast |
Design principles for high-pressure force fields: Aqueous TMAO solutions from ambient to kilobar pressures |
J. Chem. Phys. 144 (2016) 144104 |
|
Research Area: A
|
|
S. Imoto, P. Kibies, C. Rosin, R. Winter, S. M. Kast, D. Marx |
Toward Extreme Biophysics: Deciphering the Infrared Response of Biomolecular Solutions at High Pressures |
Angew. Chem. Int. Ed. 55 (2016) 9534-9538 |
|
Research Area: B
|
|
C. H. Pollok, C. Merten |
Conformational distortion of alpha-phenylethyl amine in cryogenic matrices - a matrix isolation VCD study |
Phys. Chem. Chem. Phys. 18 (2016) 13496-13502 |
|
Research Area: A
|
|
T. Osowski, J. Golbek, K. Merz, C. Merten |
Intermolecular Interactions of a Chiral Amine Borane Adduct Revealed by VCD Spectroscopy |
J. Phys. Chem. A 120 (2016) 4108-4115 |
|
Research Area: A
|
|
K. Buennemann, C. Merten |
Solvation of N,C-Protected Valine: Interactions with DMSO and a Chiral Solvating Agent |
J. Phys. Chem. B 120 (2016) 9434-9442 |
|
Research Area: B
|
|
G. Berkhan, C. Merten, C. Holec, F. Hahn |
The Interplay between a Multifunctional Dehydratase Domain and a C-Methyltransferase Effects Olefin Shift in Ambruticin Biosynthesis |
Angew. Chem. Int. Ed 55 (2016) 13589-13592 |
|
Research Area: A
|
|
N. M. Kreienborg, C. H. Pollok, C. Merten |
Towards an observation of active conformations in asymmetric catalysis: Interaction-induced conformational preferences of a chiral thiourea model compound |
Chem. Eur. J. 22 (2016) 12455-12463 |
|
Research Area: A
|
|
A. Petuker, K. Merz, C. Merten, U.-P. Apfel |
Controlled Flexible Coordination in Tripodal Iron(II) Phosphane Complexes: Effects on Reactivity |
Inorg. Chem. 55 (2016) 1183-1191 |
|
Research Area: A
|
|
V. Vasylyeva, D. W. M. Hofmann, K. Merz |
Crystal structures of 2-chloropyridine and 2-fluoropyridine: Isostructural crystal packing or not? |
Struct. Chem. 27 (2016) 331-339 |
|
Research Area: B
|
|
B. C. Hoffknecht, P. Prochnow, J. E. Bandow, N. Metzler-Nolte |
Influence of metallocene substitution on the antibacterial activity of multivalent peptide conjugates |
J. Inorg. Biochem. 160 (2016) 246-249 |
|
Research Area: B
|
|
V. Simic-Milosevic, M. Mehlhorn, K. Morgenstern |
Imaging the Bonds of Dehalogenated Benzene Radicals on Cu (111) and Au (111) |
ChemPhysChem 17 (2016) 2679-2685 |
|
Research Area: C
|
|
M. Bockstedte, A. Michl, M. Kolb, M. Mehlhorn, K. Morgenstern |
Incomplete Bilayer Termination of the Ice (0001) Surface |
J. Phys. Chem. C 120 (2016) 1097-1109 |
|
Research Area: C
|
|
M. Mehlhorn, K. Morgenstern |
Physisorption versus chemisorption of oxygen molecules on Ag (100) |
J. Chem. Phys. 144 (2016) 134706 |
|
Research Area: C
|
|
S.-C. Heidorn, C. Bertram, K. Morgenstern |
The fractal dimension of ice on the nanoscale |
Chem. Phys. Lett. 665 (2016) 1-5 |
|
Research Area: C
|
|
W. W. Dong, P. R. Chen, W. Xia, P. Weide, H. Ruland, A. Kostka, K. Kohler, M. Muhler |
Palladium Nanoparticles Supported on Nitrogen-Doped Carbon Nanotubes as a Release-and-Catch Catalytic System in Aerobic Liquid-Phase Ethanol Oxidation |
ChemCatChem 8 (2016) 1269-1273 |
|
Research Area: C
|
|
B. Konkena, K. junge Puring, I. Sinev, S. Piontek, O. Khavryuchenko, J. P. Duerholt, R. Schmid, H. Tueysuez, M. Muhler, W. Schuhmann, U.-P. Apfel |
Pentlandite rocks as highly efficient, sustainable and stable electrocatalysts for H2 generation |
Nat. Commun. 7 (2016) 12269 |
|
Research Area: C
|
|
K. Elumeeva, J. Masa, F. Tietz, F. K. Yang, W. Xia, M. Muhler, W. Schuhmann |
A Simple Approach towards High-Performance Perovskite-Based Bifunctional Oxygen Electrocatalysts |
ChemElectroChem 3 (2016) 138-143 |
|
Research Area: C
|
|
J. Masa, P. Weide, D. Peeters, I. Sinev, W. Xia, Z. Y. Sun, C. Somsen, M. Muhler, W. Schuhmann |
Amorphous Cobalt Boride (Co2B) as a Highly Efficient Nonprecious Catalyst for Electrochemical Water Splitting: Oxygen and Hydrogen Evolution |
Adv. Energy Mater. 6 (2016) 1502313 |
|
Research Area: C
|
|
Z. Sun, E. Madej, A. Genc, M. Muhler, J. Arbiol, W. Schuhmann, E. Ventos |
Demonstrating the steady performance of iron oxide composites over 2000 cycles at fast charge-rates for Li-ion batteries |
Chem. Commun. 52 (2016) 7348-7351 |
|
Research Area: C
|
|
B. Konkena, J. Masa, W. Xia, M. Muhler, W. Schuhmann |
MoSSe@reduced graphene oxide nanocomposite heterostructures as efficient and stable electrocatalysts for the hydrogen evolution reaction |
Nano Energy 29 (2016) 46-53 |
|
Research Area: C
|
|
D. Hiltrop, J. Masa, A. Maljusch, W. Xia, W. Schuhmann, M. Muhler |
Pd deposited on functionalized carbon nanotubes for the electrooxidation of ethanol in alkaline media |
Electrochem. Commun. 63 (2016) 30-33 |
|
Research Area: C
|
|
K. Elumeeva, J. Masa, J. Sierau, F. Tietz, M. Muhler, W. Schuhmann |
Perovskite-based bifunctional electrocatalysts for oxygen evolution and oxygen reduction in alkaline electrolytes |
Electrochim. Acta 208 (2016) 25-32 |
|
Research Area: C
|
|
F. Righetti, A. M. Nuss, C. Twittenhoff, S. Beele, K. Urban, S. Will, S. H. Bernhart, P. F. Stadler, P. Dersch, F. Narberhaus |
Temperature-responsive in vitro RNA structurome of Yersinia pseudotuberculosis |
Proc. Natl. Acad. Sci. U.S.A. 113 (2016) 7237-7242 |
|
Research Area: B
|
|
D. Datta, S. Kossmann, F. Neese |
Analytic energy derivatives for the calculation of the first-order molecular properties using the domain-based local pair-natural orbital coupled-cluster theory |
J. Chem. Phys. 145 (2016) 114101 |
|
Research Area: A
|
|
M. Retegan, D. A. Pantazis |
Interaction of methanol with the oxygen-evolving complex: atomistic models, channel identification, species dependence, and mechanistic implications |
Chem. Sci. 7 (2016) 6463-6476 |
|
Research Area: B
|
|
M. Isegawa, F. Neese, D. A. Pantazis |
Ionization Energies and Aqueous Redox Potentials of Organic Molecules: Comparison of DFT, Correlated ab Initio Theory and Pair Natural Orbital Approaches |
J. Chem. Theory Comput. 12 (2016) 2272-2284 |
|
Research Area: A
|
|
V. Krewald, F. Neese, D. A. Pantazis |
Redox potential tuning by redox-inactive cations in nature's water oxidizing catalyst and synthetic analogues |
Phys. Chem. Chem. Phys. 18 (2016) 10739-10750 |
|
Research Area: A
|
|
Y. Guo, K. Sivalingam, E. F. Valeev, F. Neese |
SparseMaps-A systematic infrastructure for reduced-scaling electronic structure methods. III. Linear-scaling multireference domain-based pair natural orbital N-electron valence perturbation theory |
J. Chem. Phys. 144 (2016) 94111 |
|
Research Area: A
|
|
F. Pavosevic, P. Pinski, C. Riplinger, F. Neese, E. F. Valeev |
SparseMaps-A systematic infrastructure for reduced-scaling electronic structure methods. IV. Linear-scaling second-order explicitly correlated energy with pair natural orbitals |
J. Chem. Phys. 144 (2016) 144109 |
|
Research Area: A
|
|
A. K. Vatti, M. Todorova, J. Neugebauer |
Ab Initio Determined Phase Diagram of Clean and Solvated Muscovite Mica Surfaces |
Langmuir 32 (2016) 1027-1033 |
|
Research Area: C
|
|
M. Elkins, H. Williams, D. M. Neumark |
Isotope Effect on Hydrated Electron Relaxation Dynamics Studied with Time-Resolved Liquid Jet Photoelectron Spectroscopy |
J. Chem. Phys. 144 (2016) 184503 |
|
Research Area: A
|
|
P. K. Verma, A. Steinbacher, A. Schmiedel, P. Nuernberger, T. Brixner |
Excited-state intramolecular proton transfer of 2-acetylindan-1,3-dione studied by ultrafast absorption and fluorescence spectroscopy |
Struct. Dyn. 3 (2016) 23606 |
|
Research Area: A
|
|
S. Schott, L. Ress, J. Hrusak, P. Nuernberger, T. Brixner |
Identification of photofragmentation patterns in trihalide anions by global analysis of vibrational wavepacket dynamics in broadband transient absorption data |
Phys. Chem. Chem. Phys. 18 (2016) 33287-33302 |
|
Research Area: A
|
|
J. Knorr, P. Sokkar, S. Schott, P. Costa, W. Thiel, W. Sander, E. Sanchez-Garcia, P. Nuernberger |
Competitive Solvent-Molecule Interactions Govern Primary Processes of Diphenylcarbene in Solvent Mixtures |
Nat. Commun. 7 (2016) 12968 |
|
Research Area: A
|
|
A. S. Bandarenka, R. Williams, N. Plumere |
Anodic Desorption Monitored by Voltammetric and Gravimetric Measurements for Fast Estimation of Surface Coverage of Complex Organic Molecules on Au Electrodes |
Electroanalysis 28 (2016) 2382-2388 |
|
Research Area: C
|
|
K. P. Sokol, D. Mersch, V. Hartmann, J. Z. Zhang, M. M. Nowaczyk, M. Roegner, A. Ruff, W. Schuhmann, N. Plumere, E. Reisner |
Rational wiring of photosystem II to hierarchical indium tin oxide electrodes using redox polymers |
Energy Environ. Sci. 9 (2016) 3698-3709 |
|
Research Area: B
|
|
P. Pinyou, A. Ruff, S. Poller, S. Barwe, M. Nebel, N. G. Alburquerque, E. Wischerhoff, A. Laschewsky, S. Schmaderer, J. Szeponik, N. Plumere, W. Schuhmann |
Thermoresponsive amperometric glucose biosensor |
Biointerphases 11 (2016) 11001 |
|
Research Area: B
|
|
J. Calow, A. J. Behrens, S. Mader, U. Bockau, W. B. Struwe, D. J. Harvey, K. U. Cormann, M. M. Nowaczyk, K. Loser, D. Schinor, M. W. W. Hartmann, M. Crispin |
Antibody production using a ciliate generates unusual antibody glycoforms displaying enhanced cell-killing activity |
MAbs 8 (2016) 1498-1511 |
|
Research Area: B
|
|
D. Ziehe, B. Diinschede, M. Zenker, S. Funke, M. M. Nowaczyk, D. Schuenemann |
The Chloroplast SRP Systems of Chaetosphaeridium globosum and Physcomitrella patens as Intermediates in the Evolution of SRP-Dependent Protein Transport in Higher Plants |
PLoS One 11 (2016) 166818 |
|
Research Area: B
|
|
S. Heinz, A. Rast, L. Shao, A. Gutu, I. L. Gugel, E. Heyno, M. Labs, B. Rengstl, S. Viola, M. M. Nowaczyk, D. Leister, J. Nickelsen |
Thylakoid Membrane Architecture in Synechocystis Depends on CurT, a Homolog of the Granal CURVATURE THYLAKOID1 Proteins |
Plant. Cell. 28 (2016) 2238-2260 |
|
Research Area: B
|
|
T. Voepel, E. N. Saw, V. Hartmann, R. Williams, F. Mueller, W. Schuhmann,N. Plumere, M. Nowaczyk, S. Ebbinghaus, C. Roegner |
Simultaneous measurements of photocurrents and H2O2 evolution from solvent exposed Photosystem 2 complexes |
Biointerphases 11 (2016) 19001 |
|
Research Area: B
|
|
H. Mistry, A. Varela, C. S. Bonifacio, I. Zegkinoglou, I. Sinev, Y.-W. Choi, K. Kisslinger, E. A. Stach, J. C. Yang, P. Strasser, B. Roldan Cuenya |
Highly selective plasma-activated copper catalysts for carbon dioxide reduction to ethylene |
Nat. Commun. 7 (2016) 12123 |
|
Research Area: C
|
|
H. Mistry, A. Varela, S. Kuehl, P. Strasser, B. Roldan Cuenya |
Nanostructured electrocatalysts with tunable activity and selectivity, |
Nat. Rev. Mater. 1 (2016) 16009 |
|
Research Area: C
|
|
Y. Choi, I. Sinev, H. Mistry, I. Zegkinoglou, B. Roldan Cuenya |
Probing the Dynamic Structure and Chemical State of Au Nanocatalysts during the Electrochemical Oxidation of 2-Propanol |
ACS Catal. 6 (2016) 3396-3403 |
|
Research Area: C
|
|
O. Lupan, V. Cretu, V. Postica, M. Ahmadi, B. Roldan Cuenya, L. Chow, I. Tiginyanu, B. Viana, T. Pauporte, R. Adelung |
Silver-doped zinc oxide single nanowire multifunctional nanosensor with a significant enhancement in response |
Sens. Actuators B Chem. 223 (2016) 893-903 |
|
Research Area: C
|
|
M. Ahmadi, F. Behafarid, B. Roldan Cuenya |
Size-dependent adhesion energy of shape-selected Pd and Pt nanoparticles |
Nanoscale 8 (2016) 11635-11641 |
|
Research Area: C
|
|
M. Ahmadi, H. Mistry, B. Roldan Cuenya |
Tailoring the Catalytic Properties of Metal Nanoparticles via Support Interactions |
J. Phys. Chem. Lett. 7 (2016) 3519-3533 |
|
Research Area: C
|
|
H. Mistry, F. Behafarid, R. Reske, A. S. Varela, P. Strasser, B. Roldan Cuenya |
Tuning Catalytic Selectivity at the Mesoscale via Interparticle Interactions |
ACS Catal. 6 (2016) 1075-1080 |
|
Research Area: C
|
|
J. Masa, S. Barwe, C. Andrpnescu, I. Sinev, A. Ruff, K. Jayaramulu, K. Elumeeva, B. Konkena, B. R. Cuenya, W. Schuhmann |
Low Overpotential Water Splitting Using Cobalt-Cobalt Phosphide Nanoparticles Supported on Nickel Foam |
ACS Energy Lett. 1 (2016) 1192-1198 |
|
Research Area: C
|
|
S. Bauer, J. A. Finlay, I. Thome, K. Nolte, S. C. Franco, E. Ralston, G. E. Swain, A. S. Clare, A. Rosenhahn |
Attachment of Algal Cells to Zwitterionic Self-Assembled Monolayers Comprised of Different Anionic Compounds |
Langmuir 32 (2016) 5663-5671 |
|
Research Area: B
|
|
M. Hanke-Roos, G. R. Meseck, A. Rosenhahn |
Catch bond interaction allows cells to attach to strongly hydrated interfaces |
Biointerphases 11 (2016) 18905 |
|
Research Area: C
|
|
S. Bauer, M. Alles, M. P. Arpa-Sancet, E. Ralston, G. W. Swain, N. Aldred, A. S. Clare, J. A. Finlay, M. E. Callow, J. A. Callow, A. Rosenhahn |
Resistance of Amphiphilic Polysaccharides against Marine Fouling Organisms |
Biomacromolecules 17 (2016) 897-904 |
|
Research Area: B
|
|
A. R. von Gundlach, V. M. Garamus, T. Gorniak, H. A. Davies, M. Reischl, R. Mikut, K. Hilpert , A. Rosenhahn |
Small angle X-ray scattering as a high-throughput method to classify antimicrobial modes of action |
Biochim. Biophys. Acta Biomembr. 1858 (2016) 918-925 |
|
Research Area: B
|
|
M. Valtiner, A. Erbe, A. Rosenhahn |
Ions and solvation at biointerfaces - Preface |
Biointerphases 11 (2016) 18801 |
|
Research Area: C
|
|
S. Mohammad, C. Held, E. Altuntepe, T. Kose, G. Sadowski |
Influence of Salts on the Partitioning of 5-Hydroxymethylfurfural in Water/MIBK |
J. Phys. Chem. B 120 (2016) 3797-3808 |
|
Research Area: A
|
|
M. Voges, F. Schmidt, D. Wolff, G. Sadowski, C. Held |
Thermodynamics of the alanine aminotransferase reaction |
Fluid Phase Equilib. 422 (2016) 87-98 |
|
Research Area: B
|
|
H. F. Bettinger, C. Tonshoff, M. Doerr, E. Sanchez-Garcia |
Electronically Excited States of Higher Acenes up to Nonacene: A Density Functional Theory/Multireference Configuration Interaction Study |
J. Chem. Theory Comput. 12 (2016) 305-312 |
|
Research Area: A
|
|
A. Arumughan, Y. Roske, C. Barth, L. Forero, K. Bravo-Rodriguez, A. Redel, K. Faelber, K. Rau, T. Mielke, O. Daumke, E. Sanchez-Garcia, O. Rocks, D. Panakova, U. Heinemann, E. Wanker |
Quantitative interaction mapping reveals an extended ubiquitin regulatory domain in ASPL that disrupts functional p97 hexamers |
Nat. Commun. 7 (2016) 13047 |
|
Research Area: B
|
|
S. Henkel, C. H. Pollok, T. Schleif, W. Sander |
Azulenylcarbenes: Rearrangements on the C11H8 Potential Energy Surface |
Chem. Eur. J. 22 (2016) 12479-12486 |
|
Research Area: A
|
|
J. Mieres-Perez, S. Henkel, E. Mendez-Vega, T. Schleif, T. Lohmiller, A. Savitsky, W. Sander |
Dinitreno pentaradicals: organic sextet molecules |
J. Phys. Org. Chem. 30 (2016) e3621 |
|
Research Area: A
|
|
G. Richter, E. Mendez-Vega, W. Sander |
Singlet Halophenylcarbenes as Strong Hydrogen-Bond Acceptors |
J. Phys. Chem. A 120 (2016) 3524-3532 |
|
Research Area: A
|
|
Y. A. Tsegaw, W. Sander, R. I. Kaiser |
Electron Paramagnetic Resonance Spectroscopic Study on Nonequilibrium Reaction Pathways in the Photolysis of Solid Nitromethane (CH3NO2) and D3-Nitromethane (CD3NO2) |
J. Phys. Chem. A 120 (2016) 1577-1587 |
|
Research Area: A
|
|
M. Foerstel, Y. A. Tsegaw, P. Maksyutenko, A. M. Mebel, W. Sander, R. I. Kaiser |
On the Formation of N3H3 Isomers in Irradiated Ammonia Bearing Ices: Triazene (H2NNNH) or Triimide (HNHNNH) |
ChemPhysChem 17 (2016) 2726-2735 |
|
Research Area: A
|
|
I. Shelaev, M. Gorka, A. Savitsky, V. Kurashov, M. Mamedov, F. Gostev, K. Moebius, V. Nadtochenko, J. Golbeck, A. Semenov |
Effect of Dehydrated Trehalose Matrix on the Kinetics of Forward Electron Transfer Reactions in Photosystem I |
Z..Phys. Chem. (N F) 231 (2016) 325-345 |
|
Research Area: B
|
|
O. Fisette, S. Wingbermuhle, R. Tampe, L. V. Schaefer |
Molecular mechanism of peptide editing in the tapasin-MHC I complex |
Sci. Rep. 6 (2016) 19085 |
|
Research Area: B
|
|
M. Priess, L. V. Schaefer |
Release of Entropic Spring Reveals Conformational Coupling Mechanism in the ABC Transporter BtuCD-F |
Biophys. J. 110 (2016) 2407-2418 |
|
Research Area: B
|
|
J. P. Duerholt, R. Galvelis, R. Schmid |
Coarse graining of force fields for metal-organic frameworks |
Dalton Trans. 45 (2016) 4370-4379 |
|
Research Area: A
|
|
J. P. Duerholt, J. Keupp, R. Schmid |
The Impact of Mesopores on the Mechanical Stability of HKUST-1: A Multiscale Investigation |
Eur. J. Inorg. Chem. 2016 (2016) 4517-4523 |
|
Research Area: B
|
|
M. P. Ruby, F. Schueth |
Synthesis of N-alkyl-4-vinylpyridinium-based cross-linked polymers and their catalytic performance for the conversion of fructose into 5-hydroxymethylfurfural |
Green Chem. 18 (2016) 3422-3429 |
|
Research Area: C
|
|
D. Pankratov, F. Conzuelo, P. Pinyou, S. Alsaoub, W. Schuhmann, S. Shleev |
A Nernstian Biosupercapacitor |
Angew. Chem. Int. Ed. 55 (2016) 15434-15438 |
|
Research Area: C
|
|
G. Garcia, W. Schuhmann, E. Ventosa |
A Three-Electrode, Battery-Type Swagelok Cell for the Evaluation of Secondary Alkaline Batteries: The Case of the Ni-Zn Battery |
ChemElectroChem 3 (2016) 592-597 |
|
Research Area: C
|
|
V. Essmann, S. Barwe, J. Masa, W. Schuhmann |
Bipolar Electrochemistry for Concurrently Evaluating the Stability of Anode and Cathode Electrocatalysts and the Overall Cell Performance during Long-Term Water Electrolysis |
Anal. Chem. 88 (2016) 8835-8840 |
|
Research Area: C
|
|
X. X. Chen, A. J. R. Botz, J. Masa, W. Schuhmann |
Characterisation of bifunctional electrocatalysts for oxygen reduction and evolution by means of SECM |
J. Solid. State Electrochem. 20 (2016) 1019-1027 |
|
Research Area: C
|
|
P. Pinyou, A. Ruff, S. Poller, S. Ma, R. Ludwig, W. Schuhmann |
Design of an Os Complex-Modified Hydrogel with Optimized Redox Potential for Biosensors and Biofuel Cells |
Chem. Eur. J. 22 (2016) 5319-5326 |
|
Research Area: B
|
|
A. Estrada-Vargas, D. Jambrec, Y. Ugur Kayran, V. Kuznetsov, W. Schuhmann |
Differentiation between single- and double-stranded DNA by local capacitance measurements |
ChemElectroChem 3 (2016) 855-857 |
|
Research Area: C
|
|
J. Masa, W. Schuhmann |
Electrocatalysis and bioelectrocatalysis - Distinction without a difference |
Nano Energy 29 (2016) 466-475 |
|
Research Area: C
|
|
R. Gutkowski, W. Schuhmann |
Electrochemically induced sol-gel deposition of ZnO films on Pt-nanoparticle modified FTO surfaces for enhanced photoelectrocatalytic energy conversion |
Phys. Chem. Chem. Phys. 18 (2016) 10758-10763 |
|
Research Area: C
|
|
R. Gutkowski, D. Peeter, W. Schuhmann |
Improved photoelectrochemical performance of electrodeposited metal-doped BiVO4 on Pt-nanoparticle modified FTO surfaces |
J. Mater. Chem. A 4 (2016) 7875-7882 |
|
Research Area: C
|
|
A. Estrada-Vargas, A. Bandarenka, V. Kuznetsov, W. Schuhmann |
In Situ Characterization of Ultrathin Films by Scanning Electrochemical Impedance Microscopy |
Anal. Chem. 88 (2016) 3354-3362 |
|
Research Area: C
|
|
Y. Ishige, S. Klink, W. Schuhmann |
Intercalation compounds as inner reference electrodes enable reproducible and robust solid-contact ion-selective electrodes |
Angew. Chem. Int. Ed. 55 (2016) 4831-4835 |
|
Research Area: C
|
|
F. Conzuelo, S. Grutzke, L. Stratmann, J. M. Pingarron, W. Schuhmann |
Interrogation of immunoassay platforms by SERS and SECM after enzyme-catalyzed deposition of silver nanoparticles |
MCA 183 (2016) 281-287 |
|
Research Area: C
|
|
M. Marquitan, J. Clausmeyer, P. Actis, A. L. Cordoba, Y. Korchev, M. D. Mark, S. Herlitze, W. Schuhmann |
Intracellular Hydrogen Peroxide Detection Using Functionalised Nanoelectrodes |
ChemElectroChem 3 (2016) 2125-2129 |
|
Research Area: C
|
|
J. Clausmeyer, J. Masa, E. Ventosa, D. Ohl, W. Schuhmann |
Nanoelectrodes reveal the electrochemistry of single nickelhydroxide nanoparticles |
Chem. Commun. 52 (2016) 2408-2411 |
|
Research Area: C
|
|
J. Clausmeyer, W. Schuhmann |
Nanoelectrodes: Applications in electrocatalysis, single-cell analysis and high-resolution electrochemical imaging |
Trends Analyt. Chem. 79 (2016) 46-59 |
|
Research Area: C
|
|
D. Jambrec, F. Conzuelo, A. Estrada-Vargas, W. Schuhmann |
Potential-Pulse-Assisted Formation of Thiol Monolayers within Minutes for Fast and Controlled Electrode Surface Modification |
ChemElectroChem 3 (2016) 1484-1489 |
|
Research Area: C
|
|
Y. U. Kayran, V. Essmann, S. Gruetzke, W. Schuhmann |
Selection of highly SERS active nanostructures from a size gradient of Au nanovoids on a single bipolar electrode |
ChemElectroChem 3 (2016) 399-403 |
|
Research Area: C
|
|
Y. Zhang, J. Clausmeyer, B. Babakinejad, A. L. Cordoba, T. Ali, A. Shevchuk, Y. Takahashi, P. Novak, C. Edwards, M. Lab, S. Gopal, C. Chiappini, U. Anand, L. Magnani, R. C. Coombes, J. Gorelik, T. Matsue, W. Schuhmann, D. Klenerman, E. V. Sviderskaya, Y. Korchev |
Spearhead Nanometric Field-Effect Transistor Sensors for Single-Cell Analysis |
ACS Nano 10 (2016) 3214-3221 |
|
Research Area: C
|
|
J. Clausmeyer, A. Botz, D. Ohl, W. Schuhmann |
The oxygen reduction reaction at the three-phase boundary: nanoelectrodes modified with Ag nanoclusters |
Faraday Discuss. 193 (2016) 241-250 |
|
Research Area: C
|
|
P. Pinyou, A. Ruff, S. Poller, S. Alsaoub, S. Leimkuhler, U. Wollenberger, W. Schuhmann |
Wiring of the aldehyde oxidoreductase PaoABC to electrode surfaces via entrapment in low potential phenothiazine-modified redox polymers |
Bioelectrochemistry 109 (2016) 24-30 |
|
Research Area: C
|
|
A. Ganassin, A. Maljusch, V. Colic, L. Spanier, K. Brandl, W. Schuhmann, A. Bandarenka |
Benchmarking the Performance of Thin-Film Oxide Electrocatalysts for Gas Evolution Reactions at High Current Densities |
ACS Catal. 6 (2016) 3017-3024 |
|
Research Area: C
|
|
J. Tymoczko, F. Calle-Vallejo, W. Schuhmann, A. S. Bandarenka |
Making the hydrogen evolution reaction in polymer electrolyte membrane electrolysers even faster |
Nat. Commun. 7 (2016) 10990 |
|
Research Area: C
|
|
D. M. Morales, J. Masa, C. Andronescu, Y. U. Kayran, Z. Sun, W. Schuhmann |
Few-layer graphene modified with nitrogen-rich metallo-macrocyclic complexes as precursor for bifunctional oxygen electrocatalysts |
Electrochim. Acta 222 (2016) 1191-1199 |
|
Research Area: C
|
|
J. Clausmeyer, P. Wilde, T. Loffler, E. Ventosa, K. Tschulik, W. Schuhmann |
Detection of individual nanoparticle impacts using etched carbon nanoelectrodes |
Electrochem. Commun. 73 (2016) 67-70 |
|
Research Area: C
|
|
A. Ismail-Ali, E. K. Fansa, N. Pryk, S. Yahiaoui, S. Kushnir, M. Pflieger, A. Wittinghofer, F. Schulz |
Biosynthesis-driven Structure-Activity Relationship Study of Premonensin-Derivatives |
Org. Biomol. Chem. 14 (2016) 7671-7675 |
|
Research Area: B
|
|
G. Wang, X. Deng, D. Gu, K. Chen, H. Tueysuez, B. Spliethoff, H. J. Bongard, C. Weidenthaler, W. Schmidt, F. Schueth |
Co3O4 nanoparticles supported on mesoporous carbon for selective transfer hydrogenation of alpha,beta-unsaturated aldehydes |
Angew. Chem. Int. Ed. 55 (2016) 11101-11105 |
|
Research Area: C
|
|
G. Prieto, H. Tueysuez, N. Duyckaerts, J. Knossalla, G. H. Wang, F. Schueth |
Hollow Nano- and Microstructures as Catalysts |
Chem. Rev. 116 (2016) 14056-14119 |
|
Research Area: C
|
|
A. E. Smith, L. Z. Zhou, A. H. Gorensek, M. Senske, G. J. Pielak |
In-cell thermodynamics and a new role for protein surfaces |
Proc. Natl. Acad. Sci. U.S.A. 113 (2016) 1725-1730 |
|
Research Area: B
|
|
M. Senske, A. E. Smith, G. J. Pielak |
Protein Stability in Reverse Micelles |
Angew. Chem. Int. Ed. 55 (2016) 3586-3589 |
|
Research Area: B
|
|
J. Gujt, M. Bester-Rogac, E. Spohr |
Structure and Stability of Long Rod-like Dodecyltrimethylammonium Chloride Micelles in Solutions of Hydroxybenzoates: A Molecular Dynamics Simulation Study |
Langmuir 32 (2016) 8275-8286 |
|
Research Area: B
|
|
T. Vasilevskaya, W. Thiel |
Periodic Boundary Conditions in QM/MM Calculations: Implementation and Tests |
J. Chem. Theory Comput. 12 (2016) 3561-3570 |
|
Research Area: B
|
|
T. Vasilevskaya, M. G. Khrenova, A. V. Nemukhin, W. Thiel |
Methodological Aspects of QM/MM Calculations: A Case Study on Matrix Metalloproteinase-2 |
J. Comput. Chem. 37 (2016) 1801-1809 |
|
Research Area: B
|
|
T. Vasilevskaya, M. G. Khrenova, A. V. Nemukhin, W. Thiel |
Reaction Mechanism of Matrix Metalloproteinases with a Catalytically Active Zinc Ion Studied by the QM(DFTB)/MM Simulations |
Mendeleev Commun. 26 (2016) 209-211 |
|
Research Area: B
|
|
S. Henkel, P. Costa, L. Klute, P. Sokkar, M. Fernandez-Oliva, W. Thiel, E. Sanchez-Garcia, W. Sander |
Switching the Spin State of Diphenylcarbene via Halogen Bonding |
J. Am. Chem. Soc. 138 (2016) 1689-1697 |
|
Research Area: A
|
|
C. J. Sahle, C. Sternemann, C. Giacobbe, Y. Yan, C. Weis, M. Harder, Y. Forov, G. Spiekermann, M. Tolan, M. Krisch, A. Remhof |
Formation of CaB6 in the thermal decomposition of the hydrogen storage material Ca(BH4)2 |
Phys. Chem. Chem. Phys. 18 (2016) 19866-19872 |
|
Research Area: A
|
|
F. Lehmkuehler, Y. Forov, T. Buning, C. J. Sahle, I. Steinke, K. Julius, T. Buslaps, M. Tolan, M. Hakala, C. Sternemann |
Intramolecular structure and energetics in supercooled water down to 255 K |
Phys. Chem. Chem. Phys. 18 (2016) 6925-6930 |
|
Research Area: A
|
|
B. Nowak, M. Paulus, J. Nase, P. Salmen, P. Degen, F. J. Wirkert, V. Honkimaeki, M. Tolan |
Solid-Supported Lipid Multilayers under High Hydrostatic Pressure |
Langmuir 32 (2016) 2638-2643 |
|
Research Area: C
|
|
F. Giebel, M. Paulus, J. Nase, I. Kiesel, S. Bieder, M. Tolan |
The interaction between stearic acid monolayers and butane under elevated pressures |
Colloids Surf. A Physicochem. Eng. Asp. 504 (2016) 126-130 |
|
Research Area: C
|
|
E. M. Hall, K. Tschulik, C. Batchelor-McAuley, R. G. Compton |
Electrochemical bromination of organosulfur containing species for the determination of the strength of garlic (A. sativum) |
Food Chem. 199 (2016) 817-821 |
|
Research Area: C
|
|
E. N. Saw, V. Grasmik, C. Rurainsky, M. Epple, K. Tschulik |
Electrochemistry at single bimetallic nanoparticles - using nano impacts for sizing and compositional analysis of individual AgAu alloy nanoparticles |
Faraday Discuss. 193 (2016) 327-338 |
|
Research Area: C
|
|
K. Shimizu, K. Tschulik, R. G. Compton |
Exploring the mineral-water interface: reduction and reaction kinetics of single hematite (alpha-Fe2O3) nanoparticles |
Chem. Sci. 7 (2016) 1408-1414 |
|
Research Area: C
|
|
M. J. Yang, C. Batchelor-McAuley, L. Goncalves, C. Lima, V. Vyskocil, K. Tschulik, R. G. Compton |
Ferrocene Aryl Derivatives for the Redox Tagging of Graphene Nanoplatelets |
Electroanalysis 28 (2016) 197-202 |
|
Research Area: C
|
|
F. Karnbach, X. G. Yang, G. Mutschke, J. Frohlich, J. Eckert, A. Gebert, K. Tschulik, K. Eckert, M. Uhlemann |
Interplay of the Open Circuit Potential-Relaxation and the Dissolution Behavior of a Single H-2 Bubble Generated at a Pt Microelectrode |
J. Phys. Chem. C 120 (2016) 15137-15146 |
|
Research Area: C
|
|
X. T. Li, C. Batchelor-McAuley, S. A. I. Whitby, K. Tschulik, L. D. Shao, R. G. Compton |
Single Nanoparticle Voltammetry: Contact Modulation of the Mediated Current |
Angew. Chem. Int. Ed. 55 (2016) 4296-4299 |
|
Research Area: C
|
|
L. R. Holt, B. J. Plowman, N. P. Young, K. Tschulik, R. G. Compton |
The Electrochemical Characterization of Single Core-Shell Nanoparticles |
Angew. Chem. Int. Ed. 55 (2016) 397-400 |
|
Research Area: C
|
|
T. Grewe, H. Tueysuez |
Activated carbon templated crystalline tantalates for photocatalytic hydrogen production |
ChemNanoMat 2 (2016) 273-280 |
|
Research Area: C
|
|
T. Grewe, H. Tueysuez |
Alkali metals incorporated ordered mesoporous tantalum oxide with enhanced photocatalytic activity for water splitting |
J. Mater. Chem. A 4 (2016) 3007-3017 |
|
Research Area: C
|
|
Y. Deng, H.-J. Bongard, C. K. Chan, H. Tueysuez |
Dual Templated Cobalt Oxide for Photochemical Water Oxidation |
ChemSusChem 9 (2016) 409-415 |
|
Research Area: C
|
|
T. Grewe, T. Yang, H. Tueysuez, C. K. Chan |
Hyperbranched potassium lanthanum titanate perovskite photocatalysts for hydrogen generation |
J. Mater. Chem. A 4 (2016) 2837-2841 |
|
Research Area: C
|
|
T. Grewe, M. Meggouh, H.Tueysuez |
Nanocatalysts for solar water splitting for hydrogen evolution |
Chem. Asian J. 11 (2016) 22-42 |
|
Research Area: C
|
|
G. Dodekatos, H. Tueysuez |
Plasmonic Au/TiO2 nanostructures for glycerol oxidation |
Catal. Sci. Technol. 6 (2016) 7307-7315 |
|
Research Area: C
|
|
K. Chen, X. Deng, R. Goddard, H. Tueysuez |
Pseudomorphic transformation of organometal halide perovskite using the gaseous hydrogen halide reaction |
Chem. Mater. 28 (2016) 530-5537 |
|
Research Area: C
|
|
X. Deng, C. Chan, H. Tueysuez |
Spent tea leaf templating of cobalt-based mixed oxide nanocrystals for water oxidation |
ACS. App. Mater. Interfaces 8 (2016) 32488-32495 |
|
Research Area: C
|
|
G. Dodekatos, S. Schuenemann, H. Tueysuez |
Surface plasmon assisted solar energy conversion |
Top. Curr. Chem 371 (2016) 215-252 |
|
Research Area: C
|
|
S. Schuenemann, K. Chen, S. Brittman, E. Garnett, H. Tueysuez |
Preparation of Organometal Halide Perovskite Photonic Crystal Films for Potential Optoelectronic Applications |
ACS Appl. Mater. Interfaces 8 (2016) 25489-25495 |
|
Research Area: C
|
|
C. K. Chan, H. Tueysuez, A. Braun, C. Ranjan, F. La Mantia, B. K. Miller, L. Zhang, P. A.Crozier, J. A. Haber, J. M. Gregoire, H. S. Park, A. S. Batchellor, L. Trotochaud, S. W. Boettcher |
Advanced and In Situ Analytical Methods for Solar Fuel Materials |
Top. Curr. Chem 371 (2016) 253-324 |
|
Research Area: C
|
|
P. Stock, M. Mueller, T. Utzig, M. Valtiner |
How specific halide adsorption varies hydrophobic interactions |
Biointerphases 11 (2016) 19007 |
|
Research Area: A
|
|
F. Geppert, D. Liu, M. van Eerten-Jansen, E. Weidner, C. Buismann, A. ter Heijne |
Bioelectrochemical Power-to-Gas: State of the Art and Future Perspectives |
Trends Biotechnol. 34 (2016) 879-894 |
|
Research Area: B
|
|
J. M. Lopes, S. Kareth, M. D. Bermejo, A. Martin, E. Weidner, M. J. Cocero |
Experimental determination of viscosities and densities of mixtures carbon dioxide+1-ally1-3-methylimidazolium chloride. Viscosity correlation |
J. Supercrit. Fluids 111 (2016) 91-96 |
|
Research Area: A
|
|
P. Ilieva, A. Kilzer, E. Weidner |
Measurement of solubility, viscosity, density and interfacial tension of the systems tristearin and CO2 and rapeseed oil and CO2 |
J. Supercrit. Fluids 117 (2016) 40-49 |
|
Research Area: A
|
|
T. Q. Luong, N. Erwin, M. Neumann, A. Schmidt, C. Loos, V. Schmidt, M. Fandrich, R. Winter |
Hydrostatic Pressure Increases the Catalytic Activity of Amyloid Fibril Enzymes |
Angew. Chem. Int. Ed. 55 (2016) 12412-12416 |
|
Research Area: B
|
|
D. Das Mahanta, A. Patra, N. Samanta, T. Q. Luong, B. Mukherjee, R. K. Mitra |
Non-monotonic dynamics of water in its binary mixture with 1,2-dimethoxy ethane: A combined THz spectroscopic and MD simulation study |
J. Chem. Phys. 145 (2016) 164501 |
|
Research Area: A
|
|
S. Patra, N. Erwin, R. Winter |
Translational Dynamics of Lipidated Ras Proteins in the Presence of Crowding Agents and Compatible Osmolytes |
ChemPhysChem 17 (2016) 2164-2169 |
|
Research Area: B
|
|
M. Berghaus, M. Paulus, P. Salmen, S. Al-Ayoubi, M. Tolan, R. Winter |
Near-Surface and Bulk Behavior of Bicontinuous Microemulsions under High Pressure Conditions |
J. Phys. Chem. B 120 (2016) 7148-7153 |
|
Research Area: B
|
|
J. Schulze, J. Moeller, J. Weine, K. Julius, N. Koenig, J. Nase, M. Paulus, M. Tolan, R. Winter |
Phase Behavior of Lysozyme Solutions in the Liquid-Liquid Phase Coexistence Region at High Hydrostatic Pressures |
Phys. Chem. Chem. Phys. 18 (2016) 14252-14256 |
|
Research Area: B
|
|
G. A. Cisneros, K. T. Wikfeldt, L. Ojamae, J. B. Lu, Y. Xu, H. Torabifard, A. P. Bartok, G. Csanyi, V. Molinero, F. Paesani |
Modeling Molecular Interactions in Water: From Pairwise to Many Body Potential Energy Functions |
Chem. Rev. 116 (2016) 7501-7528 |
|
Research Area: A
|
|
J. Behler |
Constructing high-dimensional neural network potentials: A tutorial review |
Int. J. Quantum Chem. 115 (2015) 1032-1050 |
|
Research Area: C
|
|
S. K. Natarajan, T. Morawietz, J. Behler |
Representing the potential-energy surface of protonated water clusters by high-dimensional neural network potentials |
Phys. Chem. Chem. Phys. 17 (2015) 8356-8371 |
|
Research Area: C
|
|
L. Dobrzycki, P. Taraszewska, R. Boese, M. K. Cyranski, S. A. Cirkel |
Towards Clathrates: Frozen States of Hydration of tert-Butylamine |
Angew. Chem. Int. Ed. 54 (2015) 10138-10144 |
|
Research Area: A
|
|
E. Bordignon, A. I. Nalepa, A. Savitsky, L. Braun, G. Jeschke |
Changes in the Microenvironment of Nitroxide Radicals around the Glass Transition Temperature |
J. Phys. Chem. B 119 (2015) 13797-13806 |
|
Research Area: B
|
|
M. Senske, L. Toerk, B. Born, M. Havenith, C. Herrmann, S. Ebbinghaus |
Enthalpy Mediated Protein Stabilization by Macromolecular Crowding |
Biophys. J. 108 (2015) 51a |
|
Research Area: B
|
|
D. Gnutt, M. Gao, O. Brylski, M. Heyden, S. Ebbinghaus |
Excluded-Volume effects in Living Cells |
Angew. Chem. Int. Ed. 54 (2015) 2548-2551 |
|
Research Area: B
|
|
T. Voepel, R. Scholz, L. Davico, M. Gross, S. Buening, S. Kareth, E. Weidner, S. Ebbinghaus |
Infrared laser triggered release of bioactive compounds from single hard shell microcapsules |
Chem. Commun. 51 (2015) 6913-6916 |
|
Research Area: C
|
|
M. Gao, K. Estel, J. Seeliger, R. P. Friedrich, S. Dogan, E. E. Wanker, R. Winter, S. Ebbinghaus |
Modulation of human IAPP fibrillation: Cosolutes, crowders and chaperones |
Phys. Chem. Chem. Phys. 17 (2015) 8338-8348 |
|
Research Area: B
|
|
J. Rechmann, A. Sarfraz, A. C. Goetzinger, E. Dirksen, T. J. J. Mueller, A. Erbe |
Surface Functionalization of Oxide-Covered Zinc and Iron with Phosphonated Phenylethynyl Phenothiazine |
Langmuir 31 (2015) 7306-7316 |
|
Research Area: C
|
|
A. Paunoiu, R. S.Moirangthem, A. Erbe |
Whispering gallery modes in intrinsic TiO2 microspheres couple to the defect-related photoluminescence after visible excitation |
Phys. Status Solidi Rapid Res. Lett. 9 (2015) 241-243 |
|
Research Area: C
|
|
D. Iqbal, A. Sarfraz, M. Stratmann, A. Erbe |
Solvent-starved conditions in confinement cause chemical oscillations excited by passage of a cathodic delamination front |
Chem. Commun. 51 (2015) 16041-16044 |
|
Research Area: C
|
|
H. Banh, C. Gemel, R. W. Seidel, R. A. Fischer |
A solvated zinc analogue of the calomel-dication |
Chem. Commun. 51 (2015) 2170-2172 |
|
Research Area: A
|
|
S. Wannapaiboon, M. Tu, K. Sumida, K. Khaletskaya, S. Furukawa, S. Kitagawa, R. A. Fischer |
Hierarchical structuring of metal-organic framework thin-films on quartz crystal microbalance (QCM) substrates for selective adsorption applications |
J. Mater. Chem. A 3 (2015) 23385-23394 |
|
Research Area: C
|
|
A. Schneemann, E. D. Bloch, S. Henke, P. L. Llewellyn, J. R. Long, R. A. Fischer |
Influence of Solvent-Like Sidechains on the Adsorption of Light Hydrocarbons in Metal-Organic Frameworks |
Chem. Eur. J. 21 (2015) 18764-18769 |
|
Research Area: C
|
|
C. Roesler, R. A. Fischer |
Metal-organic frameworks as hosts for Nanoparticles |
Cryst. Eng. Comm. 17 (2015) 199-217 |
|
Research Area: C
|
|
K. Freitag, C. Gemel, P. Jerabek, Iris M. Oppel, R. W. Seidel, G. Frenking, H. Banh, K. Dilchert, R. A. Fischer |
The sigma-Aromatic Clusters (Zn3)+ and (Zn2Cu): Embryonic Brass |
Angew. Chem. Int. Ed. 54 (2015) 4370-4374 |
|
Research Area: A
|
|
K. Khaletskaya, A. Pougin, R. Medishetty, C. Roesler, C. Wiktor, J. Strunk, R. A. Fischer |
Fabrication of Gold/Titania Photocatalyst for CO2 Reduction Based on Pyrolytic Conversion of the Metal-Organic Framework NH2-MIL-125(Ti) Loaded with Gold Nanoparticles |
Chem. Mater. 27 (2015) 7248-7257 |
|
Research Area: C
|
|
I. Luz, C. Roesler, K. Epp, F. X. Llabres i Xamena, R. A. Fischer |
Pd@UiO-66-Type MOFs Prepared by Chemical Vapor Infiltration as Shape-Selective Hydrogenation Catalysts |
Eur. J. Inorg. Chem. 2015 (2015) 3904-3912 |
|
Research Area: C
|
|
N. K. Graf, D. H. Friese, N. O. C. Winter, C. Haettig |
Excited state polarizabilities for CC2 using the resolution-of-the-identity approximation |
J. Chem. Phys. 143 (2015) 244108 |
|
Research Area: A
|
|
D. Hrsak, A. M. Khah, O. Christiansen, C. Haettig |
Polarizable Embedded RI-CC2 Method for Two-Photon Absorption Calculations |
J. Chem. Theory Comput. 11 (2015) 3669-3678 |
|
Research Area: A
|
|
C. Y. Cheng, J. S. Song, J. Pas, L. H. H. Meijer, S. Han |
DMSO Induces Dehydration near Lipid Membrane Surfaces |
Biophys. J. 109 (2015) 330-339 |
|
Research Area: C
|
|
J. Song, T. H. Kang, M. W. Kim, S. Han |
Ion specific effects: decoupling ion-ion and ion-water interactions |
Phys. Chem. Chem. Phys. 17 (2015) 8306-8322 |
|
Research Area: A
|
|
J. Noth, R. Kositzki, K. Klein, M. Winkler, M. Haumann, T. Happe |
Lyophilization protects [FeFe]-hydrogenases against O2-induced H-cluster degradation |
Sci. Rep. 5 (2015) 13978 |
|
Research Area: B
|
|
A. A. Oughli, F. Conzuelo, M. Winkler, T. Happe, W. Lubitz, W. Schuhmann, O. Ruediger, N. Plumere |
A Redox Hydrogel Protects the O2-Sensitive [FeFe]-Hydrogenase from Chlamydomonas reinhardtii from Oxidative Damage |
Angew. Chem. Int. Ed. 54 (2015) 12329-12333 |
|
Research Area: B
|
|
D. Decka, G. Schwaab, M. Havenith |
A THz/FTIR fingerprint of the solvated proton: evidence for Eigen structure and Zundel dynamics |
Phys. Chem. Chem. Phys. 17 (2015) 11898-11907 |
|
Research Area: A
|
|
D. Leicht, D. Habig , G. Schwaab, M. Havenith |
Complexation of allyl radicals and hydrochlorid acid in helium nanodroplets |
J. Phys. Chem. A 119 (2015) 1007-1012 |
|
Research Area: A
|
|
Y. Xu, M. Havenith |
Perspective: Watching low-frequency vibrations of water in biomolecular recognition by THz spectroscopy |
J. Chem. Phys. 143 (2015) 170901 |
|
Research Area: B
|
|
D. Habig, D. Leicht, G. Schwaab, M. Havenith |
Reassignment of ny2,3 IR band of the allyl radical in liquid helium nanodroplets |
J. Chem. Phys. 143 (2015) 24308 |
|
Research Area: A
|
|
L. Knake, G. Schwaab, K. Kartaschew, M. Havenith |
Solvation dynamics of trimethylamine N-Oxide in aqueous solution probed by Terahertz spectroscopy |
J. Phys. Chem. B 119 (2015) 13842-13851 |
|
Research Area: B
|
|
M. Havenith |
Solvation Science: A new interdisciplinary field |
Angew. Chem. Int. Ed. 55 (2015) 1218-1219 |
|
Research Area: A-C
|
|
F. Boehm, V. Sharma, G. Schwaab, M. Havenith |
The low frequency modes of solvated ions and ion pairs in aqueous electrolyte solutions: iron(II) and iron(III) chloride |
Phys. Chem. Chem. Phys. 17 (2015) 19582-19591 |
|
Research Area: A
|
|
S. Bauer, J. Stern, F. Boehm, C. Gainaru, M. Havenith, T. Loerting, R. Boehmer |
Vibrational study of anharmonicity, supramolecular structure, and hydrogen bonding in two octanol isomers |
Vib. Spectrosc. 79 (2015) 59-66 |
|
Research Area: A
|
|
E. Decaneto, S. Suladze, C. Rosin, M. Havenith, W. Lubitz, R. Winter |
Pressure and Temperature Effects on the Activity and Structure of the Catalytic Domain of Human MT1-MMP |
Biophys. J. 109 (2015) 2371-2381 |
|
Research Area: B
|
|
K. Morgenstern, D. Marx, M. Havenith, M. Muhler |
Editorial of the PCCP themed issue on "Solvation Science" |
Phys. Chem. Chem. Phys. 17 (2015) 8295-8296 |
|
Research Area: A-C
|
|
K. Hanke, M. Kaufmann, G. Schwaab, M. Havenith, C. T. Wolke, O. Gorlova, M. A. Johnson, B. Prasad Kar, W. Sander, E. Sanchez-Garcia |
Understanding the ionic liquid [NC4111][NTf2] from individual building blocks: An IR-spectroscopic study |
Phys. Chem. Chem. Phys. 17 (2015) 8518-8529 |
|
Research Area: A
|
|
R. G. Weiss, M. Heyden, J. Dzubiella |
Curvature Dependence of Hydrophobic Hydration Dynamics |
Phys. Rev. Lett. 114 (2015) 187802 |
|
Research Area: B
|
|
Y. Fichou, M. Heyden, G. Zaccai, M. Weik, D. J. Tobias |
Molecular Dynamics Simulations of a Powder Model of the Intrinsically Disordered Protein Tau |
J. Phys. Chem. B 119 (2015) 12580-12589 |
|
Research Area: B
|
|
S. H. Jungbauer, S. M. Huber |
Cationic multidentate halogen bond donors in halide abstraction organocatalysis: catalyst optimization by preorganization |
J. Am. Chem. Soc. 137 (2015) 12110-12120 |
|
Research Area: A
|
|
J. R. Frost, S. M. Huber, S. Breitenlechner, C. Bannwarth, T. Bach |
Enantiotopos-Selective C-H Oxygenation Catalyzed by a Supramolecular Ruthenium Complex |
Angew. Chem. Int. Ed. 54 (2015) 691-695 |
|
Research Area: C
|
|
S. H. Jungbauer, S. Schindler, E. Herdtweck, S. Keller, S. M. Huber |
Multiple Multidentate Halogen Bonding in Solution, in the Solid State, and in the (Calculated) Gas Phase |
Chem. Eur. J. 21 (2015) 13625-13636 |
|
Research Area: A
|
|
A. Linke, S. H. Jungbauer, S. M. Huber, S. R. Waldvogel |
Potent affinity material for tracing acetone and related analytes based on molecular recognition by halogen bonds |
Chem. Commun. 51 (2015) 2040-2043 |
|
Research Area: A
|
|
K. Tang, M. Knipp, B. B. Liu, N. Cox, R. Stabel, Q. He, M. Zhou, H. Scheer, K. H. Zhao, W. Gaertner |
Redox-dependent Ligand Switching in a Sensory Heme-binding GAF Domain of the Cyanobacterium Nostoc sp PCC7120 |
J. Biol. Chem. 290 (2015) 19067-19080 |
|
Research Area: B
|
|
R. Trocoli, F. La Mantia |
An Aqueous Zinc-Ion Battery Based on Copper Hexacyanoferrate |
ChemSusChem 8 (2015) 481-485 |
|
Research Area: C
|
|
A. Battistel, F. La Mantia |
Intermodulated non-linear analysis of a redox couple in solution. 1. The model |
Electrochim. Acta 176 (2015) 1484-1491 |
|
Research Area: C
|
|
A. Battistel, A. Petkovic, F. La Mantia |
Intermodulated non-linear analysis of a redox couple in solution. 2. Experimental results |
Electrochim. Acta 176 (2015) 1492-1499 |
|
Research Area: C
|
|
R. Trocoli, A. Battistel, F. La Mantia |
Nickel Hexacyanoferrate as Suitable Alternative to Ag for Electrochemical Lithium Recovery |
ChemSusChem 8 (2015) 2514-2519 |
|
Research Area: C
|
|
G. Zampardi, F. La Mantia, W. Schuhmann |
Determination of the formation and range of stability of the SEI on glassy carbon by local electrochemistry |
RSC Adv. 5 (2015) 31166-31171 |
|
Research Area: C
|
|
G. Zampardi, F. La Mantia, W. Schuhmann |
In-operando evaluation of the effect of vinylene carbonate on the insulating character of the solid electrolyte interphase |
Electrochem. Commun. 58 (2015) 1-5 |
|
Research Area: C
|
|
H. X. Wang, Y. Yoda, H. Ogata, Y. Tanaka, W. Lubitz |
A strenuous experimental journey searching for spectroscopic evidence of a bridging nickel-iron-hydride in [NiFe] hydrogenase |
J. Synchrotron Radiat. 22 (2015) 1334-1344 |
|
Research Area: B
|
|
P. Rodriguez-Macia, A. Dutta, W. Lubitz, W. J. Shaw, O. Ruediger |
Direct Comparison of the Performance of a Bio-inspired Synthetic Ni-Catalyst and a [NiFe]-Hydrogenase Covalently Attached to Electrodes |
Angew. Chem. Int. Ed. 54 (2015) 12303-12307 |
|
Research Area: B
|
|
H. Ogata, K. Nishikawa, W. Lubitz |
Hydrogens detected by subatomic resolution protein crystallography in a NiFe hydrogenase |
Nature 520 (2015) 571-574 |
|
Research Area: B
|
|
K. Moebius, M. Plato, G. Klihm, C. Laurich, A. Savitsky, W. Lubitz, B. Szyszko, M. Stepien, L. Latos-Grazynski |
Moebius-Hueckel topology switching in an expanded porphyrin cation radical as studied by EPR and ENDOR spectroscopy |
Phys. Chem. Chem. Phys. 17 (2015) 6644-6652 |
|
Research Area: A
|
|
C. M. He, B. D. Howes, G. Smulevich, S. Rumpel, E. J. Reijerse, W. Lubitz, N. Cox, M. Knipp |
Nitrite Dismutase Reaction Mechanism: Kinetic and Spectroscopic Investigation of the Interaction between Nitrophorin and Nitrite |
J. Am. Chem. Soc. 137 (2015) 4141-4150 |
|
Research Area: A
|
|
N. Cox, A. Nalepa, M.-E. Pandelia, W. Lubitz, A. Savitsky |
Pulse Double-Resonance EPR Techniques for the Study of Metallobiomolecules |
In Methods in Enzymology edited by P. Z. Qin and K. Warncke 563 (2015) 211-249 |
|
Research Area: A
|
|
K. Moebius, A. Savitsky, A. Nalepa, M. Malferrari, F. Francia, W. Lubitz, G. Venturoli |
The Magic of Disaccharide Glass Matrices for Protein Function as Decoded by High-Field EPR and FTIR Spectroscopy |
Appl. Magn. Reson. 46 (2015) 435-464 |
|
Research Area: B
|
|
E. Decaneto, S. Abbruzzetti, I. Heise, W. Lubitz, C. Viappiani, M. Knipp |
A Caged Substrate Peptide for Matrix Metalloproteinases |
Photochem. Photobiol. Sci. 14 (2015) 300-307 |
|
Research Area: B
|
|
N. Cox, D. A. Pantazis, F. Neese, W. Lubitz |
Artificial photosynthesis: understanding water splitting in nature |
Interface Focus 5 (2015) 20150009 |
|
Research Area: B
|
|
H. Ogata, T. Kraemer, H. Wang, D. Schilter, V. Pelmenschikov, M. van Gastel, F. Neese, T. B. Rauchfuss, L. B. Gee, A. D. Scott, Y. Yoda, Y. Tanaka, W. Lubitz, S. P. Cramer |
Hydride Bridge in [NiFe]-hydrogenase Observed by Nuclear Resonance Vibrational Spectroscopy |
Nat. Commun. 6 (2015) 7890 |
|
Research Area: B
|
|
V. Fourmond, S. Stapf, H. G. Li, D. Buesen, J. Birrell, O. Ruediger, W. Lubitz, W. Schuhmann, N. Plumere, C. Leger |
Mechanism of Protection of Catalysts Supported in Redox Hydrogel Films |
J. Am. Chem. Soc. 137 (2015) 5494-5505 |
|
Research Area: B
|
|
L. Martinez-Suarez, N. Siemer, J. Frenzel, D. Marx |
Reaction Network of Methanol Synthesis over Cu/ZnO Nanocatalysts |
ACS Catal. 5 (2015) 4201-4218 |
|
Research Area: C
|
|
M. Smiechowski, J. Sun, H. Forbert, D. Marx |
Solvation shell resolved THz spectra of simple aqua ions - distinct distance- and frequency-dependent contributions of solvation shells |
Phys. Chem. Chem. Phys. 17 (2015) 8323-8329 |
|
Research Area: A
|
|
S. Imoto, H. Forbert, D. Marx |
Water structure and solvation of osmolytes at high hydrostatic pressure: pure water and TMAO solutions at 10 kbar versus 1 bar |
Phys. Chem. Chem. Phys. 17 (2015) 24224-24237 |
|
Research Area: A
|
|
D. Marx, K. Morgenstern, M. Havenith, M. Muhler |
At the heart of the Ruhr metropolis: Bochum explores solvation science |
Bunsen-Magazin 17 (2015) 33-35 |
|
Research Area: A-C
|
|
D. Marx, K. Morgenstern, M. Havenith, M. Muhler |
Solvation Science - main topic of the Bunsentagung |
Bunsen-Magazin 17 (2015) 36-37 |
|
Research Area: A-C
|
|
C. Merten, V. Smyrniotopoulos, D. Tasdemir |
Assignment of absolute configurations of highly flexible linear diterpenes from the brown alga Bifurcaria bifurcata by VCD spectroscopy |
Chem. Commun. 51 (2015) 16217-16220 |
|
Research Area: A
|
|
M. Potowski, C. Merten, A. P. Antonchick, H. Waldmann |
Catalytic Aerobic Oxidation and Tandem Enantioselective Cycloaddition in Cascade Multicomponent Synthesis |
Chem. Eur. J. 21 (2015) 4913-4917 |
|
Research Area: A
|
|
M. W. Lui, C. Merten, M. J. Ferguson, R. McDonald, Y. Xu, E. Rivard |
Contrasting Reactivities of Silicon and Germanium Complexes Supported by an N-Heterocyclic Guanidine Ligand |
Inorg. Chem. 54 (2015) 2040-2049 |
|
Research Area: A
|
|
S. Murarka, Z. J. Jia, C. Merten, C. G. Daniliuc, A. P. Antonchick, H. Waldmann |
Rhodium(II)-Catalyzed Enantioselective Synthesis of Troponoids |
Angew. Chem. Int. Ed. 54 (2015) 7653-7656 |
|
Research Area: A
|
|
A. Petuker, C. Merten, U.-P. Apfel |
Modulating Sonogashira Cross-Coupling Reactivity in Four-Coordinate Nickel Complexes by Using Geometric Control |
Eur. J. Inorg. Chem. 2015 (2015) 2139-2144 |
|
Research Area: A
|
|
C. Merten, C. Pollok, S. Liao, B. List |
Stereochemical Communication within a Chiral Ion Pair Catalyst |
Angew. Chem. Int. Ed. 54 (2015) 8841-8845 |
|
Research Area: A
|
|
M. Patra, M. Wenzel, P. Prochnow, V. Pierroz, G. Gasser, J. E. Bandow, N. Metzler-Nolte |
An organometallic structure-activity relationship study reveals the essential role of a Re(CO)(3) moiety in the activity against gram-positive pathogens including MRSA |
Chem. Sci. 6 (2015) 214-224 |
|
Research Area: B
|
|
K. Merz, A. Kupka |
Deuterium Perturbs the Molecular Arrangement in the Solid State |
Cryst. Growth Des. 15 (2015) 1553-1558 |
|
Research Area: C
|
|
B. C. Hoffknecht, D. J. Worm, S. Bobersky, P. Prochnow, J. E. Bandow, N. Metzler-Nolte |
Influence of the Multivalency of Ultrashort Arg-Trp-Based Antimicrobial Peptides (AMP) on Their Antibacterial Activity |
ChemMedChem 10 (2015) 1564-1569 |
|
Research Area: B
|
|
M. Maschke, J. Grohmann, C. Nierhaus, M. Lieb, N. Metzler-Nolte |
Peptide Bioconjugates of Electron-Poor Metallocenes: Synthesis, Characterization, and Anti-Proliferative Activity |
Chembiochem 16 (2015) 1333-1342 |
|
Research Area: B
|
|
C. Muegge, T. Marzo, L. Massai, J. Hildebrandt, G. Ferraro, P. Rivera-Fuentes, N. Metzler-Nolte, A. Merlino, L. Messori, W. Weigand |
Platinum(II) Complexes with O,S Bidentate Ligands: Biophysical Characterization, Antiproliferative Activity, and Crystallographic Evidence of Protein Binding |
Inorg. Chem. 54 (2015) 8560-8570 |
|
Research Area: B
|
|
B. C. Hoffknecht, H. B. Albada, M. Sturm, P. Prochnow, J. E. Bandow, N. Metzler-Nolte |
Synthesis and antibacterial activity of trivalent ultrashort Arg-Trp-based antimicrobial peptides (AMPs) |
Med. Chem. Comm. 6 (2015) 372-376 |
|
Research Area: B
|
|
A. Gross, H. Alborzinia, S. Piantavigna, L. L. Martin, S. Wolfl, N. Metzler-Nolte |
Vesicular disruption of lysosomal targeting organometallic polyarginine bioconjugates |
Metallomics 7 (2015) 371-384 |
|
Research Area: B
|
|
K. Boom, M. Mueller, F. Stein, S. Ernst, K. Morgenstern |
Adsorption of a Switchable Industrial Dye on Au (111) and Ag (111) |
J. Phys. Chem. C 119 (2015) 17718-17724 |
|
Research Area: C
|
|
S. C. Heidorn, C. Bertram, P. Cabrera-Sanfelix, K. Morgenstern |
Consecutive Mechanism in the Diffusion of D2O on a NaCl(100) Bilayer |
ACS Nano 9 (2015) 3572-3578 |
|
Research Area: C
|
|
A. Bleichert, C. Zaum, K. Morgenstern |
Dependence of alloying and island composition on terrace width: Growth of Cu on Ag(100) |
Phys. Rev. B 92 (2015) 45422 |
|
Research Area: C
|
|
B. Gerss, N. Osterloh, S. C. Heidorn, K. Morgenstern |
Diffusion Limited Aggregation in Low Temperature Growth of Sodium Chloride |
Cryst. Growth Des. 15 (2015) 3046-3051 |
|
Research Area: C
|
|
J. Henzl, K. Boom, K. Morgenstern |
Influence of water on supra-molecular assembly of 4, 4'-dihydroxy azobenzene on Ag(111) |
J. Chem. Phys. 142 (2015) 101920 |
|
Research Area: C
|
|
O. Godsi, G. Corem, T. Kravchuk, C. Bertram, K. Morgenstern, H. Hedgeland, A. P. Jardine, W. Allison, J. Ellis, G. Alexandrowicz |
How Atomic Steps Modify Diffusion and Inter-adsorbate Forces: Empirical Evidence from Hopping Dynamics in Na/Cu(115) |
J. Phys. Chem. Lett. 6 (2015) 4165-4170 |
|
Research Area: C
|
|
F. Calle-Vallejo, J. Tymoczko, V. Colic, Q. Huy Vu, M. D. Pohl, K. Morgenstern, D. Loffreda, P. Sautet, W. Schuhmann, A. S. Bandarenka |
Finding optimal surface sites on heterogeneous catalysts by counting nearest neighbors |
Science 350 (2015) 185-189 |
|
Research Area: C
|
|
K. Stappert, D. Unal, E. T. Spielberg, A. V. Mudring |
Influence of the Counteranion on the Ability of 1-Dodecyl-3-methyltriazolium Ionic Liquids to Form Mesophases |
Cryst. Growth Des. 15 (2015) 752-758 |
|
Research Area: C
|
|
T. Alammar, I. Hamm, M. Wark, A. V. Mudring |
Low-temperature route to metal titanate perovskite nanoparticles for photocatalytic applications |
Appl. Catal. B 178 (2015) 20-28 |
|
Research Area: C
|
|
K. Stappert, A. V. Mudring |
Triazolium based ionic liquid crystals: effect of asymmetric substitution |
RSC Adv. 5 (2015) 16886-16896 |
|
Research Area: C
|
|
W. Dong, S. Reichenberger, S. Chu, P. Weide, H. Ruland, S. Barcikowski, P. Wagener, M. Muhler |
The effect of the Au loading on the liquid-phase aerobic oxidation of ethanol over Au/TiO2 catalysts prepared by pulsed laser ablation |
J. Catal. 330 (2015) 497-506 |
|
Research Area: C
|
|
J. Vivekananthan, J. Masa, P. R. Chen, K. P. Xie, M. Muhler, W. Schuhmann |
Nitrogen-doped carbon cloth as a stable self-supported cathode catalyst for air/H-2-breathing alkaline fuel cells |
Electrochim. Acta 182 (2015) 312-319 |
|
Research Area: C
|
|
J. Masa, W. Xia, M. Muhler, W. Schuhmann |
On the Role of Metals in Nitrogen-Doped Carbon Electrocatalysts for Oxygen Reduction |
Angew. Chem. Int. Ed. 54 (2015) 10102-10120 |
|
Research Area: C
|
|
A. Lueken, M. Muhler, J. Strunk |
On the role of gold nanoparticles in the selective photooxidation of 2-propanol over Au/TiO2 |
Phys. Chem. Chem. Phys. 17 (2015) 10391-10397 |
|
Research Area: C
|
|
D. Wagner, J. Rinnenthal, F. Narberhaus, H. Schwalbe |
Mechanistic insights into temperature-dependent regulation of the simple cyanobacterial hsp17 RNA thermometer at base-pair resolution |
Nucleic Acids Res. 43 (2015) 5572-5585 |
|
Research Area: B
|
|
O. Demel, J. Pittner, F. Neese |
A Local Pair Natural Orbital-Based Multireference Mukherjee's Coupled Cluster Method |
J. Chem. Theory Comput. 11 (2015) 3104-3114 |
|
Research Area: A
|
|
D. G. Liakos, M. Sparta, M. K. Kesharwani, J. M. L. Martin, F. Neese |
Exploring the Accuracy Limits of Local Pair Natural Orbital Coupled-Cluster Theory |
J. Chem. Theory Comput. 11 (2015) 1525-1539 |
|
Research Area: A
|
|
P. Pinski, C. Riplinger, E. F. Valeev, F. Neese |
Sparse maps-A systematic infrastructure for reduced-scaling electronic structure methods. I. An efficient and simple linear scaling local MP2 method that uses an intermediate basis of pair natural orbitals |
J. Chem. Phys. 143 (2015) 34108 |
|
Research Area: A
|
|
L. Rapatskiy, W. M. Ames, M. Perez-Navarro, A. Savitsky, J. J. Griese, T. Weyhermueller, H. S. Shafaat, M. Hoegbom, F. Neese, D. A. Pantazis, N. Cox |
Characterization of Oxygen Bridged Manganese Model Complexes Using Multifrequency 17O-Hyperfine EPR Spectroscopies and Density Functional Theory |
J. Phys. Chem. B 119 (2015) 13904-13921 |
|
Research Area: B
|
|
M. Todorova, J. Neugebauer |
Identification of bulk oxide defects in an electrochemical environment |
Faraday Discuss. 180 (2015) 97-112 |
|
Research Area: C
|
|
P. K. Verma, A. Steinbacher, F. Koch, P. Nuernberger, T. Brixner |
Monitoring ultrafast intramolecular proton transfer processes in an unsymmetric beta-diketone |
Phys. Chem. Chem. Phys. 17 (2015) 8459-8466 |
|
Research Area: A
|
|
P. Nuernberger, S. Ruetzel, T. Brixner |
Multidimensional Electronic Spectroscopy of Photochemical Reactions |
Angew. Chem. Int. Ed. 54 (2015) 11368-11386 |
|
Research Area: A
|
|
A. Steinbacher, P. Nuernberger, T. Brixner |
Optical discrimination of racemic from achiral solutions |
Phys. Chem. Chem. Phys. 17 (2015) 6340-6346 |
|
Research Area: A
|
|
F. Kanal, D. Schleier, P. Nuernberger |
Ultrafast Photogeneration of a tetrazolinyl radical |
ChemPhysChem 16 (2015) 3143-3146 |
|
Research Area: A
|
|
M. Ivanova, S. Kareth, E. T. Spielberg, A. V. Mudring, M. Petermann |
Silica ionogels synthesized with imidazolium based ionic liquids in presence of supercritical C02 |
J. Supercrit. Fluids 105 (2015) 60-65 |
|
Research Area: C
|
|
F. Zhao, F. Conzuelo, V. Hartmann, H. Li, M. M. Nowaczyk, N. Plumere, M. Roegner, W. Schuhmann |
Light Induced H2 Evolution from a Biophotocathode Based on Photosystem 1 - Pt Nanoparticles Complexes Integrated in Solvated Redox Polymers Films |
J. Phys. Chem. B 119 (2015) 13726-13731 |
|
Research Area: B
|
|
A. Contin, S. Frasca, J. Vivekananthan, S. Leimkuehler, U. Wollenberger, N. Plumere, W. Schuhmann |
A pH Responsive Redox Hydrogel for Electrochemical Detection of Redox Silent Biocatalytic Processes. Control of Hydrogel Solvation |
Electroanalysis 27 (2015) 938-944 |
|
Research Area: B
|
|
A. Contin, N. Plumere, W. Schuhmann |
Controlling the charge of pH-responsive redox hydrogels by means of redox-silent biocatalytic processes. A biocatalytic off/on-switch |
Electrochem. Commun. 51 (2015) 50-53 |
|
Research Area: C
|
|
P. Pinyou, F. Conzuelo, K. Sliozberg, J. Vivekananthan, A. Contin, S. Poeller, N. Plumere, W. Schuhmann |
Coupling of an enzymatic biofuel cell to an electrochemical cell for self-powered glucose sensing with optical readout |
Bioelectrochemistry 106 (2015) 22-27 |
|
Research Area: C
|
|
M. Ahmadi, C. Cui, H. Mistry, P. Strasser, B. Roldan Cuenya |
Carbon Monoxide-induced stability and atomic segregation phenomena in shape-selected octahedral PtNi Nanoparticles |
ACS Nano 9 (2015) 10686-10694 |
|
Research Area: C
|
|
B. Roldan Cuenya, F. Behafarid |
Nanocatalysis: Size- and Shape-dependent Chemisorption and Catalytic Reactivity |
Surf. Sci. 70 (2015) 135-187 |
|
Research Area: C
|
|
M. Ahmadi, F. Behafarid, C. Holse, J. H. Nielsen, B. Roldan Cuenya |
Shape-Selection of Thermodynamically Stabilized Colloidal Pd and Pt Nanoparticles Controlled via Support Effects |
J. Phys. Chem. C 119 (2015) 29178-29185 |
|
Research Area: C
|
|
M. M. Gonzalez, K. Bravo-Rodriguez, R. Suardiaz, J. M. G. de la Vega, L. A. Montero, E. Sanchez-Garcia, R. Crespo-Otero |
Complexes of nitric oxide with water and imidazole |
Theor. Chem. Acc. 134 (2015) 88 |
|
Research Area: B
|
|
D. H. J. Lopes, A. Attar, G. Nair, E. Y. Hayden, Z. M. Du, K. McDaniel, S. Dutt, H. Bandmann, K. Bravo-Rodriguez, S. Mittal, F.-G. Klaerner, C. Y. Wang, E. Sanchez-Garcia, T. Schrader, G. Bitan |
Molecular Tweezers Inhibit Islet Amyloid Polypeptide Assembly and Toxicity by a New Mechanism |
ACS Chem. Biol. 10 (2015) 1555-1569 |
|
Research Area: B
|
|
P. Costa, I. Trosien, M. Fernandez-Oliva, E. Sanchez-Garcia, W. Sander |
The Fluorenyl Cation |
Angew. Chem. Int. Ed. 54 (2015) 2656-2660 |
|
Research Area: A
|
|
S. Klopries, K. Bravo-Rodriguez, K. R.M. Koopmans, U. Sundermann, S. Yahiaoui, J. Arens, S. Kushnir, E. Sanchez-Garcia, F. Schulz |
Data in support of substrate flexibility of a mutated acyltransferase domain and implications for polyketide biosynthesis |
Data Brief 5 (2015) 528-536 |
|
Research Area: B
|
|
K. Bravo-Rodriguez, S. Klopries, K. R. M. Koopmans, U. Sundermann, S. Yahiaoui, J. Arens, S. Kushnir, F. Schulz, E. Sanchez-Garcia |
Substrate Flexibility of a Mutated Acyltransferase Domain and Implications for Polyketide Biosynthesis |
Chem. Biol. 22 (2015) 1425-1430 |
|
Research Area: B
|
|
P. Sokkar, E. Boulanger, W. Thiel, E. Sanchez-Garcia |
Hybrid Quantum Mechanics/Molecular Mechanics/Coarse Grained Modeling: A Triple-Resolution Approach for Biomolecular Systems |
J. Chem. Theory Comput. 11 (2015) 1809-1818 |
|
Research Area: B
|
|
E. Lump, L. M. Castellano, C. Meier, J. Seeliger, N. Erwin, B. Sperlich, C. M. Stuerzel, S. Usmani, R. M. Hammond, J. von Einem, G. Gerold, F. Kreppel, K. Bravo-Rodriguez, T. Pietschmann, V. M. Holmes, D. Palesch, O. Zirafi, D. Weissman, A. Sowislok, B. Wettig, C. Heid, F. Kirchhoff, T. Weil, F.-G. Klaerner, T. Schrader, G. Bitan, E. Sanchez-Garcia, R. Winter, J. Shorter, J. Muench |
A Molecular Tweezer Antagonizes Seminal Amyloids and HIV Infection |
eLife 4 (2015) e05397 |
|
Research Area: B
|
|
P. Costa, W. Sander |
1-Phenyl-1,2,4,6-cycloheptatetraene: the missing intermediate of the diphenylcarbene to fluorene rearrangement |
J. Phys. Org. Chem. 28 (2015) 71-74 |
|
Research Area: A
|
|
S. Henkel, W. Sander |
Activation of Molecular Hydrogen by a Singlet Carbene through Quantum Mechanical Tunneling |
Angew. Chem. Int. Ed. 54 (2015) 4603-4607 |
|
Research Area: A
|
|
J. Mieres-Perez, E. Mendez-Vega, K. Velappan, W. Sander |
Reaction of Triplet Phenylnitrene with Molecular Oxygen |
J. Org. Chem. 80 (2015) 11926-11931 |
|
Research Area: A
|
|
B. P. Kar, W. Sander |
Reversible Carbene Formation in the Ionic Liquid 1-Ethyl-3-Methylimidazolium Acetate by Vaporization and Condensation |
ChemPhysChem 16 (2015) 3603-3606 |
|
Research Area: A
|
|
A. Akimov, A. Masitov, D. Korchagin, S. Chapyshev, E. Misochko, A. Savitsky |
W-band EPR studies of high-spin nitrenes with large spin-orbit contribution to zero-field splitting |
J. Chem. Phys. 143 (2015) 84313 |
|
Research Area: A
|
|
A. Blees, K. Reichel, S. Trowitzsch, O. Fisette, C. Bock, R. Abele, G. Hummer, L. V. Schaefer, R. Tampe |
Assembly of the MHC I peptide-loading complex determined by a conserved ionic lock-switch |
Sci. Rep. 5 (2015) 17341 |
|
Research Area: B
|
|
G. Fleischmann, O. Fisette, C. Thomas, R. Wieneke, F. Tumulka, C. Schneeweiss, S. Springer, L. V. Schaefer, R. Tampe |
Mechanistic Basis for Epitope Proofreading in the Peptide Loading Complex |
J. Immunol. 195 (2015) 4503-4513 |
|
Research Area: B
|
|
A. B. Kuhn, S. M. Gopal, L. V. Schaefer |
On Using Atomistic Solvent Layers in Hybrid All-Atom/Coarse-Grained Molecular Dynamics Simulations |
J. Chem. Theory Comput. 11 (2015) 4460-4472 |
|
Research Area: B
|
|
A. Debnath, L. V. Schaefer |
Structure and Dynamics of Phospholipid Nanodiscs from All-Atom and Coarse-Grained Simulations |
J. Phys. Chem. B 119 (2015) 6991-7002 |
|
Research Area: B
|
|
S. M. Gopal, A. B. Kuhn, L. V. Schaefer |
Systematic evaluation of bundled SPC water for biomolecular simulations |
Phys. Chem. Chem. Phys. 17 (2015) 8393-8406 |
|
Research Area: B
|
|
E. Matysiak, A. J. R. Botz, J. Clausmeyer, B. Wagner, W. Schuhmann, Z. Stojek, A. M. Nowicka |
Assembling Paramagnetic Ceruloplasmin at Electrode Surfaces Covered with Ferromagnetic Nanoparticles. Scanning Electrochemical Microscopy in the Presence of a Magnetic Field |
Langmuir 31 (2015) 8176-8183 |
|
Research Area: C
|
|
S. Barwe, C. Andronescu, S. Poller, W. Schuhmann |
Codeposited Poly(benzoxazine) and Os-Complex Modified Polymethacrylate Layers as Immobilization Matrix for Glucose Biosensors |
Electroanalysis 27 (2015) 2158-2163 |
|
Research Area: C
|
|
L. Stratmann, J. Clausmeyer, W. Schuhmann |
Non-destructive Patterning of Carbon Electrodes by Using the Direct Mode of Scanning Electrochemical Microscopy |
ChemPhysChem 16 (2015) 3477-3482 |
|
Research Area: C
|
|
D. Jambrec, M. Gebala, F. La Mantia, W. Schuhmann |
Potential-Assisted DNA Immobilization as a Prerequisite for Fast and Controlled Formation of DNA Monolayers |
Angew. Chem. Int. Ed. 54 (2015) 15064-15068 |
|
Research Area: C
|
|
E. Ventosa, W. Schuhmann |
Scanning electrochemical microscopy of Li-ion batteries |
Phys. Chem. Chem. Phys. 17 (2015) 28441-28450 |
|
Research Area: C
|
|
J. Clausmeyer, D. Schaefer, M. Nebel, W. Schuhmann |
Temperature-Induced Modulation of the Sample Position in Scanning Electrochemical Microscopy |
ChemElectroChem 2 (2015) 946-948 |
|
Research Area: C
|
|
J. Tymoczko, V. Colic, A. S. Bandarenka, W. Schuhmann |
Detection of 2D phase transitions at the electrode/electrolyte interface using electrochemical impedance spectroscopy |
Surf. Sci. 631 (2015) 81-87 |
|
Research Area: C
|
|
J. Tymoczko, F. Calle-Vallejo, V. Colic, W. Schuhmann, A. S. Bandarenka |
Evaluation of the Electrochemical Stability of Model Cu-Pt(111) Near-Surface Alloy Catalysts |
Electrochim. Acta 179 (2015) 469-474 |
|
Research Area: C
|
|
V. Colic, J. Tymoczko, A. Maljusch, A. Ganassin, W. Schuhmann, A. S. Bandarenka |
Experimental Aspects in Benchmarking of the Electrocatalytic Activity |
ChemElectroChem 2 (2015) 143-149 |
|
Research Area: A
|
|
J. Tymoczko, V. Colic, A. Ganassin, W. Schuhmann, A. S. Bandarenka |
Influence of the alkali metal cations on the activity of Pt(111) towards model electrocatalytic reactions in acidic sulfuric media |
Catal. Today 244 (2015) 96-102 |
|
Research Area: C
|
|
A. Ganassin, V. Colic, J. Tymoczko, A. S. Bandarenka, W. Schuhmann |
Non-covalent interactions in water electrolysis: influence on the activity of Pt(111) and iridium oxide catalysts in acidic media |
Phys. Chem. Chem. Phys. 17 (2015) 8349-8355 |
|
Research Area: C
|
|
G. Zampardi, S. Klink, V. Kuznetsov, T. Erichsen, A. Maljusch, F. La Mantia, W. Schuhmann, E. Ventosa |
Combined AFM/SECM Investigation of the Solid Electrolyte Interphase in Li-Ion Batteries |
ChemElectroChem 2 (2015) 1607-1611 |
|
Research Area: C
|
|
C. G. Strippel, K. Sommer |
Teaching Nature of Scientific Inquiry in Chemistry: How do German chemistry teachers use labwork to teach NOSI? |
Int. J. Sci. Educ. 37 (2015) 2965-2986 |
|
Research Area: -
|
|
A. Chesnokov, O. Lisovski, D. Bocharov, S. Piskunov, Y. F. Zhukovskii, M. Wessel, E. Spohr |
Ab initio simulations on N and S co-doped titania nanotubes for photocatalytic applications |
Phys. Scr. 90 (2015) 94013 |
|
Research Area: C
|
|
S. Piskunov, O. Lisovski, J. Begens, D. Bocharov, Y. F. Zhukovskii, M. Wessel, E. Spohr |
C-, N-, S-, and Fe-Doped TiO2 and SrTiO3 Nanotubes for Visible-Light-Driven Photocatalytic Water Splitting: Prediction from First Principles |
J. Phys. Chem. C 119 (2015) 18686-18696 |
|
Research Area: C
|
|
A. K. Giri, E. Spohr |
Conformational Equilibria of Organic Adsorbates on Nanostructures in Aqueous Solution: MD Simulations |
J. Phys. Chem. C 119 (2015) 25566-25575 |
|
Research Area: C
|
|
J. Wiebe, K. Kravchenko, E. Spohr |
Electrolyte effects in a model of proton discharge on charged electrodes |
Surf. Sci. 631 (2015) 35-41 |
|
Research Area: C
|
|
D. Braun, O. Steinhauser |
The intermolecular NOE is strongly influenced by dynamics |
Phys. Chem. Chem. Phys. 17 (2015) 8509-8517 |
|
Research Area: A
|
|
C. Loerbroks, A. Heimermann, W.Thiel |
Solvent Effects on the Mechanism of Cellulose Hydrolysis: a QM/MM Study |
J. Comput. Chem. 36 (2015) 1114-1123 |
|
Research Area: B
|
|
C. Loerbroks, E. Boulanger, W. Thiel |
Solvent Influence on Cellulose 1,4-beta-Glycosidic Bond Cleavage: A Molecular Dynamics and Metadynamics Study |
Chem. Eur. J. 21 (2015) 5477-5487 |
|
Research Area: B
|
|
T. Vasilevskaya, M. G. Khrenova, A. V. Nemukhin, W. Thiel |
Mechanism of proteolysis in matrix metalloproteinase-2 revealed by QM/MM modeling |
J. Comput. Chem. 36 (2015) 1621-1630 |
|
Research Area: B
|
|
H. Haehl, I. Moeller, I. Kiesel, S. Campioni, R. Riek, D. Verdes, S. Seeger |
Alpha-Synuclein Insertion into Supported Lipid Bilayers As Seen by in Situ X-ray Reflectivity |
ACS Chem. Neurosci. 6 (2015) 374-379 |
|
Research Area: B
|
|
P. Degen, E. Zwar, I. Schulz, H. Rehage |
Magneto-responsive alginate capsules |
J. Phys. Condens. Matter 27 (2015) 194105 |
|
Research Area: C
|
|
W. Hiller, N. Engelhardt, A. L. Kampmann, P. Degen, R. Weberskirch |
Micellization and Mobility of Amphiphilic Poly(2-oxazoline) Based Block Copolymers Characterized by H-1 NMR Spectroscopy |
Macromolecules 48 (2015) 4032-4045 |
|
Research Area: C
|
|
H. Goehring, M. Paulus, P. Salmen, F. Wirkert, T. Kruse, P. Degen, S. Stuhr, H. Rehage, M. Tolan |
Salt induced reduction of lysozyme adsorption at charged interfaces |
J. Phys. Condens. Matter 27 (2015) 235103 |
|
Research Area: C
|
|
T. Grewe, H. Tueysuez |
Amorphous and crystalline sodium tantalate composites for photocatalytic water splitting |
ACS Appl. Mater. Interfaces 7 (2015) 23153-23162 |
|
Research Area: C
|
|
T. Grewe, H. Tueysuez |
Designing Photocatalysts for Hydrogen Evolution - Are Complex Preparation Strategies Necessary to Produce Active Catalysts? |
ChemSusChem 8 (2015) 3084-3091 |
|
Research Area: C
|
|
S. Schuenemann, G. Dodekatos, H. Tueysuez |
Mesoporous Silica Supported Au and AuCu Nanoparticles for Surface Plasmon Driven Glycerol Oxidation |
Chem. Mater. 27 (2015) 7743-7750 |
|
Research Area: C
|
|
K. Chen, H. Tueysuez |
Morphology-Controlled Synthesis of Organometal Halide Perovskite Inverse Opals |
Angew. Chem. Int. Ed. 54 (2015) 13806-13810 |
|
Research Area: C
|
|
X. Deng, G. Dodekatos, K. Pupovac, C. Weidenthaler, W. Schmidt, F. Schueth, H. Tueysuez |
Pseudomorphic generation of supported catalysts for glycerol oxidation |
ChemCatChem 7 (2015) 3832-3837 |
|
Research Area: C
|
|
H. W. Cheng, P. Stock, B. Moeremans, T. Baimpos, X. Banquy, F. U. Renner, M. Valtiner |
Characterizing the Influence of Water on Charging and Layering at Electrified Ionic-Liquid/Solid Interfaces |
Adv. Mater. Interfaces 2 (2015) 1500159 |
|
Research Area: C
|
|
P. Stock, T. Utzig, M. Valtiner |
Direct and quantitative AFM measurements of the concentration and temperature dependence of the hydrophobic force law at nanoscopic contacts |
J. Colloid Interface Sci. 446 (2015) 244-251 |
|
Research Area: C
|
|
B. R. Shrestha, Q. Y. Hu, T. Baimpos, K. Kristiansen, J. N. Israelachvili, M. Valtiner |
Real-Time Monitoring of Aluminum Crevice Corrosion and Its Inhibition by Vanadates with Multiple Beam Interferometry in a Surface Forces Apparatus |
J.Electrochem. 162 (2015) C327-C332 |
|
Research Area: C
|
|
T. Baimpos, B. R. Shrestha, Q. Y. Hu, G. Genchev, M. Valtiner |
Real-Time Multiple Beam Interferometry Reveals Complex Deformations of Metal-Organic-Framework Crystals upon Humidity Adsorption/Desorption |
J. Phys. Chem. C 119 (2015) 16769-16776 |
|
Research Area: C
|
|
C. Schroeder, O. Steinhauser, P. Sasisanker, H. Weingaertner |
Orientational Alignment of Amyloidogenic Proteins in Pre-Aggregated Solutions |
Phys. Rev. Lett. 114 (2015) 128101 |
|
Research Area: B
|
|
C. Rosin, K. Estel, J. Haelker, R. Winter |
Combined Effects of Temperature, Pressure and Cosolvents on the Polymerization Kinetics of Actin |
ChemPhysChem 16 (2015) 1379-1385 |
|
Research Area: B
|
|
T. Q. Luong, R. Winter |
Combined Pressure and Cosolvent Effects on Enzyme Activity - a High-Pressure Stopped-Flow Kinetic Study on alpha-Chymotrypsin |
Phys. Chem. Chem. Phys. 17 (2015) 23273-23278 |
|
Research Area: B
|
|
M. Gao, M. Berghaus, J. von der Ecken, S. Raunser, R. Winter |
Condensation Agents Determine the Temperature-Pressure Stability of F-actin Bundles |
Angew. Chem. Int. Ed. 54 (2015) 11088-11092 |
|
Research Area: B
|
|
C. Rosin, P. H. Schummel, R. Winter |
Cosolvent and Crowding Effects on the Polymerization Kinetics of Actin |
Phys. Chem. Chem. Phys. 17 (2015) 8330-8337 |
|
Research Area: B
|
|
V. P. Voloshin, N. N. Medvedev, N. Smolin, A. Geiger, R. Winter |
Disentangling Volumetric and Hydrational Properties of Proteins |
J. Phys. Chem. B 119 (2015) 1881-1890 |
|
Research Area: B
|
|
V. P. Voloshin, N. N. Medvedev, N. Smolin, A. Geiger, R. Winter |
Exploring Volume, Compressibility and Hydration Changes of Folded Proteins upon Compression |
Phys. Chem. Chem. Phys. 17 (2015) 8499-8508 |
|
Research Area: B
|
|
M. Erlkamp, J. Marion, N. Martinez, C. Czeslik, J. Peters, R. Winter |
Influence of Pressure and Crowding on the Sub-Nanosecond Dynamics of Globular Proteins |
J. Phys. Chem. B 119 (2015) 4842-4848 |
|
Research Area: B
|
|
M. Gao, R. Winter |
Kinetic Insights into the Elongation Reaction of Actin Filaments as a Function of Temperature, Pressure, and Macromolecular Crowding |
ChemPhysChem 16 (2015) 3681-3686 |
|
Research Area: B
|
|
C. H. Hofmann, S. Grobelny, P. T. Panek, L. K. M. Heinen, A. K. Wiegand, F. A. Plamper, C. R. Jacob, R. Winter, W. Richtering |
Methanol-induced Change of the Mechanism of the Temperature- and Pressure Induced Collapse of N-substituted Acrylamide Copolymers |
J. Polym. Sci. Polym. Phys. 53 (2015) 532-544 |
|
Research Area: B
|
|
R. Winter |
Pressure Effects on Artificial and Cellular Membranes |
Subcell. Biochem. 112 (2015) 345-370 |
|
Research Area: B
|
|
R. Winter |
Pressure Effects on the Intermolecular Interaction Potential of Condensed Protein Solutions |
Subcell. Biochem. 112 (2015) 151-176 |
|
Research Area: B
|
|
S. Suladze, S. Cinar, B. Sperlich, R. Winter |
Pressure Modulation of the Enzymatic Activity of Phospholipase A2, a Putative Membrane-Associated Pressure Sensor |
J. Am. Chem. Soc. 137 (2015) 12588-12599 |
|
Research Area: B
|
|
T. Q. Luong, S. Kapoor, R. Winter |
Pressure-A Gateway to Fundamental Insights into Protein Solvation, Dynamics, and Function |
ChemPhysChem 16 (2015) 3539 |
|
Research Area: B
|
|
M. M. Gao, R. Winter |
The Effects of Lipid Membranes, Crowding and Osmolytes on the Aggregation, and Fibrillation Propensity of Human IAPP |
J. Diabetes Res. 2015 (2015) 849017 |
|
Research Area: B
|
|
B. B. Berkes, M. Huang, J. B. Henry, M. Kokoschka, A. S. Bandarenka |
Characterisation of Complex Electrode Processes using Simultaneous Impedance Spectroscopy and Electrochemical Nanogravimetric Measurements |
ChemPlusChem 79 (2014) 348-358 |
|
Research Area: C
|
|
A. S. Bandarenka, H.A. Hansen, J. Rossmeisl, I. E. L Stephens |
Elucidating the activity of stepped Pt single crystals for oxygen reduction |
Phys. Chem. Chem. Phys. 16 (2014) 13625-13629 |
|
Research Area: C
|
|
J. Behler |
Representing potential energy surfaces by high-dimensional neural network potentials |
J. Phys. Condens. Matter 26 (2014) 183001 |
|
Research Area: C
|
|
M. Senske, L. Toerk, B. Born, M. Havenith, C. Herrmann, S. Ebbinghaus |
Protein Stabilization by Macromolecular Crowding through Enthalpy Rather Than Entropy |
J. Am. Chem. Soc 136 (2014) 9036-9041 |
|
Research Area: B
|
|
B. Born, M. Heyden, S. Ebbinghaus, M. Havenith |
Probing solvation dynamics by terahertz absorption spectroscopy |
In Terahertz Biomedical Science and Technology byJoo-Hiuk Son, CRC Press 1st ed. (2014) 135-152 |
|
Research Area: B
|
|
D. Iqbal, J. Rechmann, A. Sarfraz, A. Altin, G. Genchev, A. Erbe |
Synthesis of Ultrathin Poly(methyl methacrylate) Model Coatings Bound via Organosilanes to Zinc and Investigation of Their Delamination Kinetics |
Appl. Mater. Interfaces 6 (2014) 18112-18121 |
|
Research Area: C
|
|
C. Roesler, D. Esken, C. Wiktor, H. Kobayashi, T. Yamamoto, S. Matsumura, H. Kitagawa, R. A. Fischer |
Encapsulation of Bimetallic Nanoparticles into a Metal-Organic Framework: Preparation and Microstructure Characterization of Pd/Au@ZIF-8 |
Eur. J. Inorg. Chem. 2014 (2014) 5514-5521 |
|
Research Area: C
|
|
M. Tu, C. Wiktor, C. Roesler, R. A. Fischer |
Rapid room temperature syntheses of zeolitic-imidazolate framework (ZIF) nanocrystals |
Chem. Commun. 50 (2014) 13258-13260 |
|
Research Area: C
|
|
P. Nieto, M. Letzner, T. Endres, G. Schwaab, M. Havenith |
IR spectroscopy of pyridine-water conformers in helium nanodroplets |
Phys. Chem. Chem. Phys. 16 (2014) 8384-8391 |
|
Research Area: A
|
|
D. Habig, D. Leicht, M. Kaufmann, G. Schwaab, M. Havenith |
IR-spectroscopic study of the allyl + NO reaction in helium nanodroplets |
J. Chem. Phys. 141 (2014) 044312-6 |
|
Research Area: A
|
|
V. Conti Nibali, M. Havenith |
New insights into the role of water in biological function: Studying solvated biomolecules using terahertz absorption spectroscopy in conjunction with molecular dynamics simulations |
J. Am. Chem. Soc. 136 (2014) 12800-12807 |
|
Research Area: B
|
|
A. Patra, T. Q. Luong, R. K. Mitra, M. Havenith |
The influence of charge on the structure and dynamics of water encapsulated in reverse micelles |
Phys. Chem. Chem. Phys. 16 (2014) 12875-12883 |
|
Research Area: B
|
|
K. Meister, J. G. Duman, Y. Xu, A. L. DeVries, D. M. Leitner, M. Havenith |
The Role of Sulfates on Antifreeze Protein Activity |
J. Phys. Chem. B 118 (2014) 7920-7924 |
|
Research Area: B
|
|
V. Sharma, F. Boehm, G. Schwaab, M. Havenith |
The low frequency motions of solvated Mn(II) and Ni(II) ions and their halide complexes |
Phys. Chem. Chem. Phys. 16 (2014) 25101-25110 |
|
Research Area: C
|
|
M. Heyden, G. Schwaab, M. Havenith |
Comment on "Hydration and Mobility of Trehalose in Aqueous Solution" |
J. Phys. Chem. B 118 (2014) 10802-10805 |
|
Research Area: B
|
|
H. Vondracek, J. Dielmann-Gessner, W. Lubitz, M. Knipp, M. Havenith |
THz absorption spectroscopy of solvated beta-lactoglobulin |
J. Chem. Phys. 141 (2014) 22D534 |
|
Research Area: B
|
|
H. Ogata, E. Decaneto, M. Grossman, M. Havenith, I. Sagi, W. Lubitz, M. Knipp |
Crystallization and preliminary X-ray crystallographic analysis of the catalytic domain of membrane type 1 matrix metalloproteinase |
Acta Cryst. 70 (2014) 232-235 |
|
Research Area: A
|
|
J. Sun, G. Niehues, H. Forbert, D. Decka, G. Schwaab, D. Marx, M. Havenith |
Understanding THz Spectra of Aqueous Solutions: Glycine in Light and Heavy Water |
J. Am. Chem. Soc. 136 (2014) 5031-5038 |
|
Research Area: B
|
|
E. T. Spielberg, E. Edengeiser, B. Mallick, M. Havenith, A. V. Mudring |
1-Butyl-4-methyl-pyridinium [Cu(SCN)2]: A coordination polymer and ionic liquid |
Chem. Eur. J. 20 (2014) 5338-5345 |
|
Research Area: A
|
|
J. Dielmann-Gessner, M. Grossman, V. Conti-Nibali, B. Born, I. Solomonov, G. B. Fields, M. Havenith, I. Sagi |
Enzymatic turnover of macromolecules generates long-lasting protein-water-coupled motions beyond reaction steady state |
Proc. Natl. Acad. Sci. U.S.A. 111 (2014) 17857-17862 |
|
Research Area: B
|
|
M. Heyden |
Resolving anisotropic distributions of correlated vibrational motion in protein hydration water |
J. Chem. Phys. 141 (2014) 22D509 |
|
Research Area: B
|
|
S. H. Jungbauer, S. M. Walter, S. Schindler, L. Rout, F. Kniep, S. M. Huber |
Activation of a carbonyl compound by halogen bonding |
Chem. Commun. 50 (2014) 6281-6284 |
|
Research Area: A
|
|
S. H. Jungbauer, D. Bulfield, F. Kniep, C. W. Lehmann, E. Herdtweck, S. M. Huber |
Toward Molecular Recognition: Three-Point Halogen Bonding in the Solid State and in Solution |
J. Am. Chem. Soc. 136 (2014) 16740-16743 |
|
Research Area: A
|
|
C. Risse, J. J. Taing, M. Knipp |
Preparation of nitrophorin 7(Delta 1-3) from Rhodnius prolixus without start-methionine using recombinant expression in Escherichia coli |
Anal. Biochem. 451 (2014) 28-30 |
|
Research Area: B
|
|
A. Nalepa, K. Moebius, W. Lubitz, A. Savitsky |
High-field ELDOR-detected NMR study of a nitroxide radical in disordered solids: Towards characterization of heterogeneity of microenvironments in spin-labeled systems |
J. Magn. Reson. 242 (2014) 203-213 |
|
Research Area: A
|
|
N. Plumere, O. Ruediger, A. A. Oughli, R. Williams, J. Vivekananthan, S. Poeller, W. Schuhmann, W. Lubitz |
A redox hydrogel protects hydrogenase from high-potential deactivation and oxygen damage |
Nat. Chem. 6 (2014) 822-827 |
|
Research Area: B
|
|
M. Malferrari, A. Nalepa, G. Venturoli, F. Francia, W. Lubitz, K. Moebius, A. Savitsky |
Structural and dynamical characteristics of trehalose and sucrose matrices at different hydration levels as probed by FTIR and high-field EPR |
Phys. Chem. Chem. Phys. 16 (2014) 9831-9848 |
|
Research Area: B
|
|
F. Uhl, L. Walewski, H. Forbert, D. Marx |
Adding Flexibility to the "Particles-on-a-Sphere" Model for Large-Amplitude Motion: POSflex Force Field for Protonated Methane |
J. Chem. Phys. 141 (2014) 104110 |
|
Research Area: A
|
|
L. Martinez-Suarez, J. Frenzel, D. Marx |
Cu/ZnO nanocatalysts in response to environmental conditions: surface morphology, electronic structure, redox state and CO2 activation |
Phys. Chem. Chem. Phys. 16 (2014) 26119-26136 |
|
Research Area: C
|
|
C. Drechsel-Grau, D. Marx |
Exceptional Isotopic-Substitution Effect: Breakdown of Collective Proton Tunneling in Hexagonal Ice due to Partial Deuteration |
Angew. Chem. Int. Ed. 53 (2014) 10937-10940 |
|
Research Area: C
|
|
J. Frenzel, D. Marx |
Methanol synthesis on ZnO(0001). IV. Reaction mechanisms and electronic structure |
J. Chem. Phys. 141 (2014) 124710 |
|
Research Area: C
|
|
M. Farnesi-Camellone, D. Marx |
Nature and Role of Activated Molecular Oxygen Species at the Gold/Titania Interface in the Selective Oxidation of Alcohols |
J. Phys. Chem. C 118 (2014) 20989-21000 |
|
Research Area: C
|
|
C. Drechsel-Grau, D. Marx |
Quantum Simulation of Collective Proton Tunneling in Hexagonal Ice Crystals |
Phys. Rev. Lett. 112 (2014) 148302-1-5 |
|
Research Area: C
|
|
L. Walewski, H. Forbert, D. Marx |
Reactive path integral quantum simulations of molecules solvated in superfluid helium |
Comput. Phys. Commun. 185 (2014) 884-899 |
|
Research Area: C
|
|
L. Walewski, H. Forbert, D. Marx |
Solvation of molecules in superfluid helium enhances the "interaction induced localization" effect |
J. Chem. Phys. 140 (2014) 144305 |
|
Research Area: C
|
|
C. Merten, C. J. Berger, R. McDonald, Y. Xu |
Evidence of Dihydrogen Bonding of a Chiral Amine-Borane Complex in Solution by VCD Spectroscopy |
Angew. Chem. Int. Ed. 53 (2014) 9940-9943 |
|
Research Area: A
|
|
C. Merten, J. F. Reuther, J. D. DeSousac, B. M. Novak |
Identification of the specific, shutter-like conformational reorientation in a chiroptical switching polycarbodiimide by VCD spectroscopy |
Phys. Chem. Chem. Phys. 16 (2014) 11456-11460 |
|
Research Area: A
|
|
C. Merten, R. McDonald, Y. Xu |
Strong Solvent-Dependent Preference of Delta and Lambda Stereoisomers of a Tris(diamine)nickel(II) Complex Revealed by Vibrational Circular Dichroism Spectroscopy |
Inorg. Chem. 53 (2014) 3177-3182 |
|
Research Area: A
|
|
C. Merten, F. Li, K. Bravo-Rodriguez, E. Sanchez-Garcia, Y. Xu, W. Sander |
Solvent-induced conformational changes in cyclic peptides: a vibrational circular dichroism study |
Phys. Chem. Chem. Phys. 16 (2014) 5627-5633 |
|
Research Area: A
|
|
H. B. Albada, P. Prochnow, S. Bobersky, J. E. Bandow, N. Metzler-Nolte |
Highly active antibacterial ferrocenoylated or ruthenocenoylated Arg-Trp peptides can be discovered by an L-to-D substitution scan |
Chem. Sci. 5 (2014) 4453-4459 |
|
Research Area: B
|
|
A. Kupka, C. Schauerte, K. Merz |
Isostructural Crystallization Behavior of Dihydroanthracene and Dihydroacridine |
Cryst. Growth Des. 14 (2014) 2985-2989 |
|
Research Area: B
|
|
K. Merz, M. V. Evers, F. Uhl, R. I. Zubatyuk, O. V. Shishkin |
Role of CHF2- and CF3-Substituents on Molecular Arrangement in the Solid State: Experimental and Theoretical Crystal Structure Analysis of CH3/CHF2/CF3-Substituted Benzene |
Cryst. Growth Des. 14 (2014) 3124-3130 |
|
Research Area: B
|
|
M. Mehlhorn, S. Schnur, A. Gross, K. Morgenstern |
Molecular-Scale Imaging of Water Near Charged Surfaces |
ChemElectroChem 1 (2014) 431-435 |
|
Research Area: C
|
|
J. Henzl, K. Boom, K. Morgenstern |
Using the First Steps of Hydration for the Determination of Molecular Conformation of a Single Molecule |
J. Am. Chem. Soc. 136 (2014) 13341-13347 |
|
Research Area: A
|
|
J. Masa, W. Xia, I. Sinev, A. Zhao, Z. Sun, S. Gruetzke, P. Weide, M. Muhler, W. Schuhmann |
MnxOy/NC and CoxOy/NC Nanoparticles Embedded in a Nitrogen- Doped Carbon Matrix for High-Performance Bifunctional Oxygen Electrodes |
Angew. Chem. Int. Ed. 53 (2014) 8508-8512 |
|
Research Area: C
|
|
A. Zhao, J.s Masa, W. Xia, A. Maljusch, M. G. Willinger, G. Clavel, K. Xie, R. Schloegl, W. Schuhmann, M. Muhler |
Spinel Mn-Co Oxide in N-Doped Carbon Nanotubes as a Bifunctional Electrocatalyst Synthesized by Oxidative Cutting |
J. Am. Chem. Soc. 136 (2014) 7551-7554 |
|
Research Area: C
|
|
F. Righetti, F. Narberhaus |
How to find RNA thermometers |
Front. Cell. Infect. Microbiol. 4 (2014) 132 |
|
Research Area: B
|
|
S. Ruetzel, M. Diekmann, P. Nuernberger, C. Walter, B. Engels, T. Brixner |
Photoisomerization among ring-open merocyanines. I. Reaction dynamics and wave-packet oscillations induced by tunable femtosecond pulses |
J. Chem. Phys. 140 (2014) 224310-10 |
|
Research Area: A
|
|
C. Walter, S. Ruetzel, M. Diekmann, P. Nuernberger, T. Brixner, B. Engels |
Photoisomerization among ring-open merocyanines. II. A computational study |
J. Chem. Phys. 140 (2014) 224311-9 |
|
Research Area: A
|
|
C. Consani, S. Ruetzel, P. Nuernberger, T. Brixner |
Quantum Control Spectroscopy of Competing Reaction Pathways in a Molecular Switch |
J. Phys. Chem. A 118 (2014) 11364-11372 |
|
Research Area: A
|
|
P. K. Verma, F. Koch, A. Steinbacher, P. Nuernberge, T. Brixner |
Ultrafast UV-Induced Photoisomerization of Intramolecularly H-Bonded Symmetric beta-Diketones |
J. Am. Chem. Soc. 136 (2014) 14981-14989 |
|
Research Area: A
|
|
A. M. Hanu, S. Kareth, A. Puls, M. Ivanova, B. Mallick, A. V. Mudring, M. Petermann |
Influence of scCO2, Ultrasound, and Quaternary Ammonium Salt on Gelation Time and Structural Characteristics of Silica |
Chem. Eng. Technol. 37 (2014) 1873-1878 |
|
Research Area: C
|
|
M. Lillethorup, K. Shimizu, N. Plumere, S. U. Pedersen, K. Daasbjerg |
Surface-Attached Poly(glycidyl methacrylate) as a Versatile Platform for Creating Dual-Functional Polymer Brushes |
Macromolecules 47 (2014) 5081-5088 |
|
Research Area: C
|
|
T. Kothe, S. Poeller, F. Zhao, P. Fortgang, M. Roegner, W. Schuhmann, N. Plumere |
Engineered electron transfer chain in Photosystem 1 based photocathodes outperforms electron transfer rates in natural photosynthesis |
Chem. Eur. J. 20 (2014) 11029-11034 |
|
Research Area: B
|
|
V. Hartmann, T.Kothe, S. Poeller, E. El-Mohsnawy, M. M. Nowaczyk, N. Plumere, W. Schuhmann, M. Roegner |
Redox hydrogels with adjusted redox potential for improved efficiency in Z-scheme inspired biophotovoltaic cells |
Phys. Chem. Chem. Phys. 16 (2014) 11936-11941 |
|
Research Area: B
|
|
J. Clausmeyer, J. Henig, W. Schuhmann, N. Plumere |
Scanning Droplet Cell for Chemoselective Patterning through Local Electroactivation of Protected Quinone Monolayers |
ChemPhysChem 15 (2014) 151-156 |
|
Research Area: A
|
|
K. U. Cormann, M. Bartsch, M. Roegner, M. M. Nowaczyk |
Localization of the CyanoP binding site on photosystem II by surface plasmon resonance spectroscopy |
Front. Plant Sci. 5 (2014) 01. Okt |
|
Research Area: B
|
|
F. Behafarid, S. Pandey, R. Diaz, E. Stach, B. Roldan Cuenya |
An In situ transmission electron microscopy study of sintering and redispersion phenomena over size-selected metal nanoparticles: environmental effects |
Phys. Chem. Chem. Phys. 16 (2014) 18176-18184 |
|
Research Area: C
|
|
C. Cui, L. Gan, M. Neumann, M. Heggen, B. Roldan Cuenya, P. Strasser |
Carbon Monoxide-Assisted Size Confinement of Bimetallic Alloy Nanoparticles |
J. Am. Chem. Soc. 136 (2014) 4813-4816 |
|
Research Area: C
|
|
H. Mistry, R. Reske, Z. Zeng, Z. J. Zhao, J. Greeley, P. Strasser, B. Roldan Cuenya |
Exceptional Size-Dependent Activity Enhancement in the Electroreduction of CO2 over Au Nanoparticles |
J. Am. Chem. Soc. 136 (2014) 16473-16476 |
|
Research Area: C
|
|
Y. Fujimori, W. E. Kaden, M. A. Brown, B. Roldan Cuenya, M. Sterrer, H.-J. Freund |
Hydrogen Evolution from Metal - Surface Hydroxyl Interaction |
J. Phys. Chem. C 118 (2014) 17717-17723 |
|
Research Area: C
|
|
R. Reske, H. Mistry, F. Behafarid, B. Roldan Cuenya, P. Strasser |
Particle Size Effects in the Catalytic Electroreduction of CO2 on Cu Nanoparticles |
J. Am. Chem. Soc. 136 (2014) 6978-6986 |
|
Research Area: C
|
|
E. Lira, L. R. Merte, F. Behafarid, L. K. Ono, L. Zhang, B. Roldan Cuenya |
Role and Evolution of Nanoparticle Structure and Chemical State during the Oxidation of NO over Size- and Shape-Controlled Pt/gamma-Al2O3 Catalysts under Operando Conditions |
ACS Catal. 4 (2014) 1875-1884 |
|
Research Area: C
|
|
H. Mistry, F. Behafarid, E. Zhou, L. K. Ono, L. Zhang, B. Roldan Cuenya |
Shape-Dependent Catalytic Oxidation of 2-Butanol over Pt Nanoparticles Supported on y-Al2O3 |
ACS Catal. 4 (2014) 109-115 |
|
Research Area: C
|
|
F. Behafarid, J. Matos, S. Hong, L. Zhang, T. S. Rahman, B. Roldan Cuenya |
Structural and Electronic Properties of Micellar Au Nanoparticles: Size and Ligand Effects |
ACS Nano 8 (2014) 6671-6681 |
|
Research Area: C
|
|
S. Bauer, M. Alles, J. A. Finlay, J. A. Callow, M. E. Callow, A. Rosenhahn |
Influence of zwitterionic SAMs on protein adsorption and the attachment of algal cells |
J. Biomater. Sci. Polym. Ed. 25 (2014) 1530-1539 |
|
Research Area: C
|
|
R. Crespo-Otero, A. Mardykov, E. Sanchez-Garcia, W. Sander, M. Barbatti |
Photo-stability of peptide-bond aggregates: N-methylformamide dimers |
Phys. Chem. Chem. Phys. 16 (2014) 18877-18887 |
|
Research Area: B
|
|
W. Sander, S. Roy, K. Bravo-Rodriguez, D. Grote, E. Sanchez-Garcia |
The Benzylperoxy Radical as a Source of Hydroxyl and Phenyl Radicals |
Chem. Eur. J. 20 (2014) 12917-12923 |
|
Research Area: A
|
|
P. Costa, M. F. Oliva, E. Sanchez-Garcia, W. Sander |
The Highly Reactive Benzhydryl Cation Isolated and Stabilized in Water Ice |
J. Am. Chem. Soc. 136 (2014) 15625-15630 |
|
Research Area: A
|
|
S. Klopries, K. R. M. Koopmans, E. Sanchez-Garcia, F. Schulz |
Biosynthesis with Fluorine |
ChemBioChem 15 (2014) 495-497 |
|
Research Area: B
|
|
K. Bravo-Rodriguez, A. F. Ismail-Ali, S. Klopries, S. Kushnir, S. Ismail, E. K. Fansa, A. Wittinghofer, F. Schulz, E. Sanchez-Garcia |
Predicted Incorporation of Non-Native Substrates by a Polyketide Synthase yields Bioactive Natural Product Derivatives |
ChemBioChem 15 (2014) 1991-1997 |
|
Research Area: B
|
|
S. Henkel, M. Ertelt, W. Sander |
Deuterium and Hydrogen Tunneling in the Hydrogenation of 4-Oxocyclohexa-2,5-dienylidene |
Chem. Eur. J. 20 (2014) 7585-7588 |
|
Research Area: A
|
|
M. Ertelt, D. A. Hrovat, W. Thatcher Borden, W. Sander |
Heavy-Atom Tunneling in the Ring Opening of a Strained Cyclopropene at Very Low Temperatures |
Chem. Eur. J. 20 (2014) 4713-4720 |
|
Research Area: A
|
|
P. Costa, W. Sander |
Hydrogen Bonding Switches the Spin State of Diphenylcarbene from Triplet to Singlet |
Angew. Chem. Int. Ed. 53 (2014) 5122-5125 |
|
Research Area: A
|
|
S. V. Chapyshev, E. N. Ushakov, P. Neuhaus, W. Sander |
Matrix Isolation, Zero-Field Splitting Parameters, and Photoreactions of Septet 2,4,6-Trinitrenopyrimidines |
J. Org. Chem. 79 (2014) 6047-6053 |
|
Research Area: A
|
|
A. Korte, A. Mardyukov, W. Sander |
Pyridyl- and Pyridylperoxy Radicals - A Matrix Isolation Study |
Aust. J. Chem. 67 (2014) 1324-1329 |
|
Research Area: A
|
|
S. Eggensperger, O. Fisette, D. Parcej, L. V. Schaefer, R. Tampe |
An Annular Lipid Belt Is Essential for Allosteric Coupling and Viral Inhibition of the Antigen Translocation Complex TAP (Transporter Associated with Antigen Processing) |
J. Biol. Chem. 289 (2014) 33098-33108 |
|
Research Area: B
|
|
F. Wang, J. Mielby, F. H. Richter, G. Wang, G. Prieto, T. Kasama, C. Weidenthaler, H. J. Bongard, S. Kegnaes, A. Fuerstner, F. Schueth |
A Polypropylene Support for Pd Catalysts with Exceptional Catalytic Activity |
Angew. Chem. Int. Ed. 53 (2014) 8645-8648 |
|
Research Area: C
|
|
M. Nebel, T. Erichsen, W. Schuhmann |
Constant-distance mode SECM as a tool to visualize local electrocatalytic activity of oxygen reduction catalysts |
Beilstein J. Nanotechnol. 5 (2014) 141-151 |
|
Research Area: A
|
|
F. Conzuelo, J. Vivekananthan, S. Poeller, J. M. Pingarron, W. Schuhmann |
Immunologic-controlled biofuel cell as a self-powered biosensor for antibiotic residues determination |
ChemElectroChem 1 (2014) 1854-1858 |
|
Research Area: C
|
|
A. R. Zeradjanin, A. A.Topalov, Q. Van Overmeere, S. Cherevko, X. Chen, E. Ventosa, W. Schuhmann, K. J. J. Mayrhofer |
Rational design of the electrode morphology for oxygen evolution - enhancing the performance for catalytic water oxidation |
RSC Adv. 4 (2014) 9579-9587 |
|
Research Area: C
|
|
V. Kuznetsov, A. Maljusch, R. M. Souto, A. S. Bandarenka, W. Schuhmann |
Characterisation of localised corrosion processes using scanning electrochemical impedance microscopy |
Electrochem. Commun. 44 (2014) 38-41 |
|
Research Area: C
|
|
A. Maljusch, J. B. Henry, J. Tymoczko, A. S. Bandarenka, W. Schuhmann |
Characterisation of non-uniform functional surfaces: towards linking basic surface properties with electrocatalytic activity |
RSC Adv. 4 (2014) 1532-1537 |
|
Research Area: C
|
|
X. X. Chen, A. Maljusch, R. A. Rincon, A. Battistel, A. S. Bandarenka, W. Schuhmann |
Local visualization of catalytic activity at gas evolving electrodes using frequency-dependent scanning electrochemical microscopy |
Chem. Commun. 50 (2014) 13250-13253 |
|
Research Area: C
|
|
A S. Bandarenka, A. Maljusch, V. Kuznetsov, K. Eckhard, W. Schuhmann |
Localized Impedance Measurements for Electrochemical Surface Science |
J. Phys. Chem. C 118 (2014) 8952-8959 |
|
Research Area: C
|
|
J. Tymoczko, F. Calle-Vallejo, V. Colic, M. T. M. Koper, W. Schuhmann, A. S. Bandarenka |
Oxygen Reduction at a Cu-Modified Pt(111) Model Electrocatalyst in Contact with Nafion Polymer |
ACS Catal. 4 (2014) 3772-3778 |
|
Research Area: C
|
|
J. Tymoczko, W. Schuhmann, A. S. Bandarenka |
Position of Cu Atoms at the Pt(111) Electrode Surfaces Controls Electrosorption of (H)SO4 (2) from H2SO4 Electrolytes |
ChemElectroChem 1 (2014) 213-219 |
|
Research Area: C
|
|
A. Maljusch, E. Ventosa, R. A. Rincon, A. S. Bandarenka, W. Schuhmann |
Revealing onset potentials using electrochemical microscopy to assess the catalytic activity of gas-evolving electrodes |
Electrochem. Commun. 38 (2014) 142-145 |
|
Research Area: C
|
|
A. S. Bandarenka, E. Ventosa, A. Maljusch, J. Masa, W. Schuhmann |
Techniques and methodologies in modern electrocatalysis: evaluation of activity, selectivity and stability of catalytic materials |
Analyst 139 (2014) 1274-1291 |
|
Research Area: C
|
|
Z. Sun, X. Huang, F. Liu, X. Yang, C. Roesler, R. A. Fischer, M. Muhler, W. Schuhmann |
Amine-based solvents for exfoliating graphite to graphene outperform the dispersing capacity of N-methyl-pyrrolidone and surfactants |
Chem. Commun. 50 (2014) 10382-10385 |
|
Research Area: C
|
|
F. Zhao, K. Sliozberg, M. Roegner, N. Plumere, W. Schuhmann |
The Role of Hydrophobicity of Os-Complex-Modified Polymers for Photosystem 1 Based Photocathodes |
J. Electrochem. Soc. 161 (2014) H3035-H3041 |
|
Research Area: C
|
|
J. Arens, D. Bergs, M. Mewes, J. Merz, G. Schembecker, F. Schulz |
Heterologous fermentation of a diterpene from Alternaria brassisicola |
Mycology 5 (2014) 207-219 |
|
Research Area: B
|
|
J. Wiebe, E. Spohr |
Double layer effects in a model of proton discharge on charged electrodes |
Beilstein J. Nanotechnol. 5 (2014) 973-982 |
|
Research Area: C
|
|
J. Gujt, C. Podlipnik, M. Bester-Rogac, E. Spohr |
Ion mobility and clustering of sodium hydroxybenzoates in aqueous solutions: a molecular dynamics simulation study |
Phys. Chem. Chem. Phys. 16 (2014) 19314-26 |
|
Research Area: C
|
|
B. Karasulu, J. P. Goetze, W. Thiel |
Assessment of Franck-Condon Methods for Computing Vibrationally Broadened UV-vis Absorption Spectra of Flavin Derivatives: Riboflavin, Roseoflavin, and 5-Thioflavin |
J. Chem. Theory Comput. 10 (2014) 5549-5566 |
|
Research Area: B
|
|
P. Degen, E. Zwar, M. Paulus, M. Tolan, H. Rehage |
About the Role of Surfactants on the Magnetic Control over Liquid Interfaces |
Langmuir 30 (2014) 11563-11566 |
|
Research Area: C
|
|
P. K. Eckert, C. Golz, P. Degen, C. Werner, H. Rehage, C. Strohmann |
Exploring the Synthesis of a New Group of Chiral Ammonium Salts with Specific Configurations at the Stereogenic Nitrogen Centers |
Chem. Eur. J. 20 (2014) 3268-3272 |
|
Research Area: A
|
|
D. C. F. Wieland, P. Degen, M. Paulus, M.A. Schroer, H. Rehage, M. Tolan |
pH controlled condensation of polysiloxane networks at the water-air interface |
Colloids Surf. A Physicochem. Eng. Asp. 455 (2014) 44-48 |
|
Research Area: C
|
|
P. Degen |
Self-propelling capsules as artificial microswimmers |
Curr. Opin. Colloid Interface Sci. 19 (2014) 611-619 |
|
Research Area: C
|
|
S. P. Bierwirth, T. Buening, C. Gainaru, C. Sternemann, M. Tolan, R. Boehmer |
Supramolecular x-ray signature of susceptibility amplification in hydrogen-bonded liquids |
Phys. Rev. E 90 (2014) 052807-1-5 |
|
Research Area: C
|
|
I. Kiesel, M.Paulus, J. Nase, S. Tiemeyer, C. Sternemann, K. Ruester, F. J. Wirkert, K. Mende, T. Buening, M. Tolan |
Temperature driven adsorption and desorption of proteins at solid-liquid interfaces |
Langmuir 30 (2014) 2077-2083 |
|
Research Area: C
|
|
F. Giebel, M. Paulus, J. Nase, S. Bieder, I. Kiesel, M. Tolan |
The adsorption behavior of octafluoropropane at the water/gas interface |
J. Appl. Phys. 116 (2014) 222204-4 |
|
Research Area: C
|
|
F. J. Wirkert, M. Paulus, J. Nase, J. Moeller, S. Kujawski, C. Sternemann, M. Tolan |
X-ray reflectivity measurements of liquid/solid interfaces under high hydrostatic pressure conditions |
J. Synchrotron Radiat. 21 (2014) 76-81 |
|
Research Area: C
|
|
B. R. Shrestha, T. Baimpos, S. Raman, M. Valtiner |
Angstrom-Resolved Real-Time Dissection of Electrochemically Active Noble Metal Interfaces |
ACS Nano 8 (2014) 5979-5987 |
|
Research Area: C
|
|
T. Baimpos, B. R. Shrestha, S. Raman, M. Valtiner |
Effect of Interfacial Ion Structuring on Range and Magnitude of Electric Double Layer, Hydration, and Adhesive Interactions between Mica Surfaces in 0.05-3 M Li+ and Cs+ Electrolyte Solutions |
Langmuir 30 (2014) 4322-4332 |
|
Research Area: C
|
|
B. Schmidtke, N. Petzold, B. Poetzschner, H. Weingaertner, E. A. Roessler |
Relaxation Stretching, Fast Dynamics, and Activation Energy: A Comparison of Molecular and Ionic Liquids as Revealed by Depolarized Light Scattering |
J. Phys. Chem. B 118 (2014) 7108-7118 |
|
Research Area: C
|
|
S. Gabl, C. Schroeder, D. Braun, H. Weingaertner, O. Steinhauser |
Pair dynamics and the intermolecular nuclear Overhauser effect (NOE) in liquids analysed by simulation and model theories: Application to an ionic liquid |
J. Chem. Phys. 140 (2014) 184503 |
|
Research Area: C
|
|
V. P. Voloshin, A.V. Kim, N. N. Medvedev, R. Winter, A. Geiger |
Calculation of the volumetric characteristics of biomacromolecules in solution by the Voronoi-Delaunay technique |
Biophys. Chem. 192 (2014) 01. Sep |
|
Research Area: B
|
|
M. Erlkamp, S. Grobelny, R. Winter |
Crowding effects on the temperature and pressure dependent structure, stability and folding kinetics of Staphylococcal Nuclease |
Phys. Chem. Chem. Phys. 16 (2014) 5965-5976 |
|
Research Area: B
|
|
C. Rosin, M. Erlkamp, J. von der Ecken, S. Raunser, R. Winter |
Exploring the Stability Limits of Actin and Its Suprastructures |
Biophys. J. 107 (2014) 2982-2992 |
|
Research Area: B
|
|
C. H. Hofmann, S. Grobelny, M. Erlkamp, R. Winter, W. Richtering |
Influence of high-pressure on cononsolvency of poly(N-isopropylacrylamide) nanogels in water/methanol mixtures |
Polymer 55 (2014) 2000-2007 |
|
Research Area: B
|
|
S. Grobelny, M. Erlkamp, J. Moeller, M. Tolan, R. Winter |
Intermolecular interactions in highly concentrated protein solutions upon compression and the role of the solvent |
J. Chem. Phys. 141 (2014) 22D506 |
|
Research Area: B
|
|
M. Erlkamp, J. F. Moulin, R. Winter, C. Czeslik |
Packing Effects of N-Ras Binding to a DOPC Membrane - a Neutron Reflectivity and TIRF Spectroscopy High-Pressure Study |
Z. Phys. Chem. (N F) 228 (2014) 969-986 |
|
Research Area: B
|
|
S. Kapoor, M. Berghaus, S. Suladze, D. Prumbaum, S. Grobelny, P. Degen, S. Raunser, R. Winter |
Prebiotic Cell Membranes that Survive Extreme Environmental Pressure Conditions |
Angew. Chem. Int. Ed. 53 (2014) 8397-8401 |
|
Research Area: B
|
|
M. Erlkamp, S. Grobelny, A. Faraone, C. Czeslik, R. Winter |
Solvent Effects on the Dynamics of Amyloidogenic Insulin Revealed by Neutron Spin Echo Spectroscopy |
J. Phys. Chem. B 118 (2014) 3310-3316 |
|
Research Area: B
|
|
J. Moeller, S. Grobelny, J. Schulze, S. Bieder, A. Steffen, M. Erlkamp, M. Paulus, M. Tolan, R. Winter |
Reentrant Liquid-Liquid Phase Separation in Protein Solutions at Elevated Hydrostatic Pressures |
Phys. Rev. Lett. 112 (2014) 28101-1-5 |
|
Research Area: B
|
|
J. Moeller, S. Grobelny, J. Schulze, A. Steffen, S. Bieder, M. Paulus, M. Tolan, R. Winter |
Specific anion effects on the pressure dependence of the protein-protein interaction potential |
Phys. Chem. Chem. Phys. 16 (2014) 7423-7429 |
|
Research Area: B
|
|
A. S. Bandarenka |
Exploring the interfaces between metal electrodes and aqueous electrolytes with electrochemical impedance spectroscopy |
Analyst 138 (2013) 5540-5554 |
|
Research Area: C
|
|
M. Kokoschka, J. B. Henry, A. S. Bandarenka |
Multiparametric characterisation of non-electroactive self-assembled monolayers during their formation |
Langmuir 29 (2013) 9909-9917 |
|
Research Area: C
|
|
A .S. Bandarenka, M. T. M. Koper |
Structural and electronic effects in heterogeneous electrocatalysis: Toward a rational design of electrocatalysts |
J. Catal. 308 (2013) Nov 24 |
|
Research Area: C
|
|
F. Calle-Vallejo, M.T.M. Koper, A. S. Bandarenka |
Tailoring the catalytic activity of electrodes with monolayer amounts of foreign metals |
Chem. Soc. Rec. 42 (2013) 5210-5230 |
|
Research Area: C
|
|
F. Calle-Vallejo, M. Huang, J. B. Henry, M.T.M. Koper, A. S. Bandarenka |
Theoretical Design and Experimental Implementation of Ag/Au Electrodes for the Electrochemical Reduction of Nitrate |
Phys. Chem. Chem. Phys. 15 (2013) 3196-3202 |
|
Research Area: C
|
|
T. Morawietz, J. Behler |
A Density-Functional Theory-Based Neural Network Potential for Water Clusters Including van der Waals Corrections |
J. Phys. Chem. A 117 (2013) 7356-7366 |
|
Research Area: C
|
|
T. Morawietz, J. Behler |
A Full-Dimensional Neural Network Potential-Energy Surface for Water Clusters up to the Hexamer |
Z. Phys. Chem. (N F) 227 (2013) 1559-1581 |
|
Research Area: C
|
|
S. Henke, A. Schneemann, R. A. Fischer |
Massive Anisotropic Thermal Expansion and Thermo-Responsive Breathing in Metal-Organic Frameworks Modulated by Linker Functionalization |
Adv. Funct. Mater. 23 (2013) 5990-5996 |
|
Research Area: C
|
|
K. Sneskov, J. M. Haugaard Olsen, T. Schwabe, C. Haettig, O. Christiansen, J. Kongsted |
Computational screening of one- and two-photon spectrally tuned channelrhodopsin mutants |
Phys. Chem. Chem. Phys. 15 (2013) 7567-7576 |
|
Research Area: B
|
|
A. Patra, T. Q. Luong, R. K. Mitra, M. Havenith |
Solvent dynamics in reverse micellar water-pool: A spectroscopic investigation of DDAB/cyclohexane/water systems |
Phys. Chem. Chem. Phys. 15 (2013) 930-939 |
|
Research Area: B
|
|
M. Letzner, S. Gruen, D. Habig, K. Hanke,T. Endres, P. Nieto, G. Schwaab, L. Walewski, M. Wollenhaupt, H. Forbert, D. Marx, M. Havenith |
High resolution spectroscopy of HCl-water clusters |
J. Chem. Phys. 139 (2013) 154304-11 |
|
Research Area: A
|
|
V. Sharma, F. Boehm, M. Seitz, G. Schwaab, M. Havenith |
From solvated ions to ion-pairing: A THz study of lanthanum (III) hydration |
Phys. Chem. Chem. Phys. 15 (2013) 8383-8391 |
|
Research Area: B
|
|
M. Heyden, D. J. Tobias |
Spatial Dependence of Protein-Water Collective Hydrogen-Bond Dynamics |
Phys. Rev. Lett. 111 (2013) 218101 |
|
Research Area: B
|
|
N. Cox, W. Lubitz, A. Savitsky |
W-band ELDOR-detected NMR (EDNMR) spectroscopy as a versatile technique for the characterisation of transition metal-ligand interactions |
Mol. Phys. 111 (2013) 2788-2808 |
|
Research Area: A
|
|
L. Walewski, H. Forbert, D. Marx |
Interaction-induced localisation of protons in hydrogen bonds at superfluid helium temperatures |
Mol. Phys. 111 (2013) 2555-2569 |
|
Research Area: C
|
|
A. Witt, S. D. Ivanov, D. Marx |
Microsolvation-Induced Quantum Localization in Protonated Methane |
Phys. Rev. Lett. 110 (2013) 083003-5 |
|
Research Area: A
|
|
D. Munoz-Santiburcio, C. Wittekindt, D. Marx |
Nanoconfinement effects on hydrated excess protons in layered materials |
Nat. Commun. 4 (2013) 2349 |
|
Research Area: C
|
|
M. Farnesi-Camellone, D. Marx |
On the Impact of Solvation on a Au/TiO2 Nanocatalyst in Contract with Water |
Phys. Chem. Lett. 4 (2013) 514-518 |
|
Research Area: C
|
|
M. Siechowski, H. Forbert, D. Marx |
Spatial decomposition and assignment of infrared spectra of simple ions in water from mid-infrared to THz frequencies: Li+(aq) and F(aq) |
J. Chem. Phys. 139 (2013) 014506-15 |
|
Research Area: C
|
|
P. Dopieralski, J. Ribas-Arino, P. Anjukandi, M. Krupicka, J. Kiss, D. Marx |
The Janus-faced role of external forces in mechanochemical disulfide bond cleavage |
Nat. Chem. 5 (2013) 685-691 |
|
Research Area: A
|
|
S. D. Ivanov, A. Witt, D. Marx |
Theoretical spectroscopy using molecular dynamics: theory and application to CH5+ and its isotopologues |
Phys. Chem. Chem. Phys. 15 (2013) 10270-10299 |
|
Research Area: A
|
|
L. Martinez-Suarez, J. Frenzel, D. Marx, B. Meyer |
Tuning the Reactivity of a Cu / ZnO Nanocatalyst via Gas Phase Pressure |
Phys. Rev. Lett. 110 (2013) 086108-5 |
|
Research Area: A
|
|
M. Farnesi-Camellone, J. Zhao, L. Jin, Y. Wang, M. Muhler, D. Marx |
Molecular Understanding of Reactivity and Selectivity for Methanol Oxidation at the Au/TiO2 Interface |
Angew. Chem. Int. Ed. 52 (2013) 5780-5784 |
|
Research Area: C
|
|
T. Alammar, H. Noei, Y. Wang, A. V. Mudring |
Mild yet phase-selective preparation of TiO2 nanoparticles from ionic liquids - a critical study |
Nanoscale 5 (2013) 8045-8055 |
|
Research Area: A
|
|
M. Yang, B. Mallick, A. V. Mudring |
On the mesophase formation of 1,3-dialkylimidazolium ionic liquids |
Cryst. Growth Des. 13 (2013) 3068-3077 |
|
Research Area: B
|
|
T. Kothe, N. Plumere, A. Badura, M. M. Nowaczyck, D. A. Guschin, M. Roegner, W. Schuhmann |
Combination of A Photosystem 1-Based Photocathode and a Photosystem 2-Based Photoanode to a Z-Scheme Mimic for Biophotovoltaic Applications |
Angew. Chem. Int. Ed. 52 (2013) 14233-14236 |
|
Research Area: C
|
|
L. K. Ono, F. Behafarid, B. Roldan-Cuenya |
Nano-Gold Diggers: Au-Assisted SiO2-Decomposition and Desorption in Supported Nanocatalysts |
ACS Nano 7 (2013) 10327-10334 |
|
Research Area: C
|
|
E. W. Hernandez-Rodriguez, A. L. Montero-Alejo, R. Lopez, E. Sanchez-Garcia, L. A. Montero-Cabrera, J. M. Garcia de la Vega |
Electron Density Deformations Provide New Insights into the Spectral Shift of Rhodopsins |
J. Comput. Chem. 34 (2013) 2460-2471 |
|
Research Area: B
|
|
D. Bier, R. Rose, K. Bravo-Rodriguez, M. Bartel, J. M. Ramirez-Anguita, S. Dutt, C. Wilch, F.-G. Klaerner, E. Sanchez-Garcia, T. Schrader, C. Ottmann |
Molecular tweezers modulate 14-3-3 protein - protein interactions |
Nat. Chem. 5 (2013) 234-239 |
|
Research Area: B
|
|
S. Dutt, C. Wilch, T. Gersthagen, P. Talbiersky, K. Bravo-Rodriguez, M. Hanni, E. Sanchez-Garcia, C. Ochsenfeld, F.-G. Klaerner, T. Schrader |
Molecular Tweezers with Varying Anions: A Comparative Study |
J. Org. Chem. 78 (2013) 6721-6734 |
|
Research Area: A
|
|
F. Li, K. Bravo-Rodriguez, C. Phillips, R. W. Seidel, F. Wieberneit, R. Stoll, N. L. Doltsinis, E. Sanchez-Garcia, W. Sander |
Conformation and Dynamics of a Cyclic Disulfide-Bridged Peptide: Effects of Temperature and Solvent |
J. Phys. Chem. B 117 (2013) 3560-3570 |
|
Research Area: B
|
|
F. Li, K. Bravo-Rodriguez, M. Fernandez-Oliva, J. M. Ramirez-Anguita, K. Merz, M. Winter, C. W. Lehmann, W. Sander, E. Sanchez-Garcia |
Stereochemistry Rules: A Single Stereocenter Changes the Conformation of a Cyclic Tetrapeptide |
J. Phys. Chem. B 117 (2013) 10785-10791 |
|
Research Area: A
|
|
U. Sundermann, K. Bravo Rodriguez, S. Klopries, S. Kushnir, H. Gomez, E. Sanchez-Garcia, F. Schulz |
Enzyme-Directed Mutasynthesis: A Combined Experimental and Theoretical Approach to Substrate Recognition of a Polyketide Synthase |
ACS Chem. Biol. 8 (2013) 443-450 |
|
Research Area: B
|
|
M. Sajid, A. Lawzer, W. Dong, C. Rosorius, W. Sander, B. Schirmer, S. Grimme, C. G. Daniliuc, G. Kehr, G. Erker |
Carbonylation Reactions of Intramolecular Vicinal Frustrated Phosphone/Borane Lewis Pairs |
J. Am. Chem. Soc. 135 (2013) 18567-18574 |
|
Research Area: A
|
|
J. Masa, W. Schuhmann |
Systematic selection of metalloporphyrin based catalysts for oxygen reduction by modulation of the donor-acceptor intermolecular hardness |
Chem. Eur. J. 19 (2013) 9644-54 |
|
Research Area: C
|
|
J. Tymoczko, W. Schuhmann, A. S. Bandarenka |
A versatile electrochemical cell for the preparation and characterisation of model electrocatalytic systems |
Phys. Chem. Chem. Phys. 15 (2013) 12998-13004 |
|
Research Area: C
|
|
M. Huang, A. Maljusch, F. Calle-Vallejo, J.B. Henry, M. T. M. Koper, W. Schuhmann, A. S. Bandarenka |
Electrochemical formation and surface characterisation of Cu2-xTe thin films with adjustable content of Cu |
RSC Adv. 3 (2013) 21648-21654 |
|
Research Area: C
|
|
A. S. Bandarenka, K. Eckhard, A. Maljusch, W. Schuhmann |
Localized Electrochemical Impedance Spectroscopy: Visualization of Spatial Distributions of the Key Parameters Describing Solid / Liquid Interfaces |
Anal. Chem. 85 (2013) 2443-2448 |
|
Research Area: C
|
|
J. B. Henry, A. Maljusch, J. Tymoczko, W. Schuhmann, A. S. Bandarenka |
Preparation of thin film Cu-Pt(111) near-surface alloys: one small step towards up-scaling model single crystal surfaces |
Electrochim. Acta 112 (2013) 887-893 |
|
Research Area: C
|
|
J. Tymoczko, W. Schuhmann, A. S. Bandarenka |
The Constant Phase Element Reveals 2D Phase Transitions in Adsorbate Layers at the Electrode / Electrolyte Interfaces |
Electrochem. Commun. 27 (2013) 42-45 |
|
Research Area: C
|
|
C. Loerbroks, R. Rinaldi, W. Thiel |
The Electronic Nature of the 1,4-beta-Glycosidic Bond and its Chemical Environment: DFT Insights into Cellulose Chemistry |
Chem. Eur. J. 19 (2013) 16282-16294 |
|
Research Area: A
|
|
H. Weingaertner |
NMR studies of ionic liquids: Structure and dynamics |
Curr. Opin. Colloid Interface Sci. 18 (2013) 183-189 |
|
Research Area: C
|
|
S. Gabl, O. Steinhauser, H. Weingaertner |
From Short-Range to Long-Range Intermolecular NOEs in Ionic Liquids: Frequency Does Matter |
Angew. Chem. Int. Ed. 52 (2013) 9242-9246 |
|
Research Area: B
|
|
Y. Zhai, R. Winter |
Effect of Molecular Crowding on the Temperature-Pressure Stability Diagram of Ribonuclease A |
ChemPhysChem 14 (2013) 386-393 |
|
Research Area: B
|
|
J. Seeliger, A. Werkmueller, R. Winter |
Macromolecular Crowding as a Suppressor of Human IAPP Fibril Formation and Cytotoxicity |
PLoS One 8 (2013) e69652 |
|
Research Area: B
|
|
M. B. Prigozhin, Y. Liu, A. J. Wirth, S. Kapoor, R. Winter, K. Schulten, M. Gruebele |
Misplaced helix slows down ultrafast pressure-jump protein folding |
Proc. Natl. Acad. Sci. U.S.A. 110 (2013) 8087-8092 |
|
Research Area: B
|
|
J. Seeliger, K. Estel, N. Erwin, R. Winter |
Cosolvent effects on the fibrillation reaction of human IAPP |
Phys. Chem. Chem. Phys. 15 (2013) 8902-8907 |
|
Research Area: B
|
|
K. Meister, S. Ebbinghaus, Y. Xub, J. G. Dumanc, A. DeVries, M. Gruebele, D. M. Leitner, M. Havenith |
Long-range protein-water dynamics in hyperactive insect antifreeze proteins |
Proc. Natl. Acad. Sci. U.S.A. 110 (2012) 1617-1622 |
|
Research Area: B
|
|
D. M. Leitner, M. Gruebele, M. Havenith |
THz Technology and THz Spectroscopy: Modeling and Experiments to Study Solvation Dynamics of Biomolecules |
In Methods in Physical Chemistry by R. Schaefer and P. Schmidt 1-2 (2012) 687-710 |
|
Research Area: A
|
|
M. Heyden J. Sun, H. Forbert, G. Mathias, M. Havenith, D. Marx |
Understanding the origins of dipolar couplings and correlated motion in the vibrational spectrum of water |
J. Phys. Chem. Lett. 3 (2012) 2135-2140 |
|
Research Area: B
|