Effects of dynamical degrees of freedom on magnetic compass sensitivity: a comparison of plant and avian cryptochromes G Grüning, SY Wong, L Gerhards, F Schuhmann, DR Kattnig, PJ Hore, ...
Journal of the American Chemical Society 144 (50), 22902-22914, 2022
8 2022 Theoretical investigation of CH-bond activation by photocatalytic excited SO 2 and the effects of C-, N-, S-, and Se-doped TiO 2 L Gerhards, T Klüner
Physical Chemistry Chemical Physics 24 (4), 2051-2069, 2022
7 2022 Spin dynamics of flavoproteins J Matysik, L Gerhards, T Theiss, L Timmermann, P Kurle-Tucholski, ...
International Journal of Molecular Sciences 24 (9), 8218, 2023
6 2023 Electronic Transitions in Different Redox States of Trinuclear 5, 6, 11, 12, 17, 18‐Hexaazatrinaphthylene‐Bridged Titanium Complexes: Spectroelectrochemistry and Quantum Chemistry A Markovic, L Gerhards, P Sander, C Dosche, T Klüner, R Beckhaus, ...
ChemPhysChem 21 (22), 2506-2514, 2020
5 2020 Modeling spin relaxation in complex radical systems using MolSpin L Gerhards, C Nielsen, DR Kattnig, PJ Hore, IA Solov'yov
Journal of Computational Chemistry 44 (19), 1704-1714, 2023
3 2023 Across atoms to crossing continents: Application of similarity measures to biological location data F Schuhmann, L Ryvkin, JD McLaren, L Gerhards, IA Solov’yov
Plos one 18 (5), e0284736, 2023
3 2023 Studying folding unfolding dynamics of solvated alanine polypeptides using molecular dynamics J Hungerland, A Frederiksen, L Gerhards, IA Solov’yov
The European Physical Journal D 76 (8), 154, 2022
3 2022 The same, but different, but still the same: structural and dynamical differences of neutrophil elastase and cathepsin G F Schuhmann, X Tan, L Gerhards, HN Bordallo, IA Solov’yov
The European Physical Journal D 76 (7), 126, 2022
3 2022 Quantum Chemical Investigation of Photocatalytical Sulfoxidation of Hydrocarbons on TiO2 L Gerhards, T Klüner
The Journal of Physical Chemistry C 125 (24), 13313-13323, 2021
3 2021 Multidentate Interaction of Methylamine with Rutile TiO2 (110) L Mohrhusen, L Gerhards, D Hirsch, T Klüner, K Al-Shamery
The Journal of Physical Chemistry C 125 (22), 11975-11986, 2021
2 2021 How do Antimicrobial Peptides Interact with the Outer Membrane of Gram-Negative Bacteria? Role of Lipopolysaccharides in Peptide Binding, Anchoring, and Penetration JC Stephani, L Gerhards, B Khairalla, IA Solov’yov, I Brand
ACS Infectious Diseases, 2024
1 2024 Peculiar Differences between Two Copper Complexes Containing Similar Redox-Active Ligands: Density Functional and Multiconfigurational Calculations L Gerhards, M Werr, O Hübner, IA Solov’yov, HJ Himmel
Inorganic Chemistry 63 (2), 961-975, 2023
1 2023 Density Functional Theory Calculations for Multiple Conformers Explaining the Regio‐and Stereoselectivity of Ti‐Catalyzed Hydroaminoalkylation Reactions N Thoben, T Kaper, S de Graaff, L Gerhards, M Schmidtmann, T Klüner, ...
ChemPhysChem 24 (17), e202300370, 2023
1 2023 Biologically active drimane derivatives isolated from submerged cultures of the wood-inhabiting basidiomycete Dentipellis fragilis N Mitschke, WC Sum, K Hassan, M Kirchenwitz, H Schrey, L Gerhards, ...
RSC advances 13 (37), 25752-25761, 2023
1 2023 Charge-Transfer Promoted Fixation of Glyphosate on TiO2-a Multiscale Approach F Balzaretti, M von Einem, L Gerhards, W Dononelli, T Stauch, T Klüner, ...
1 2021 The Effect of Spin Relaxation on Magnetic Compass Sensitivity in ErCry4a G Grüning, L Gerhards, SY Wong, D Kattnig, I Solov'yov
ChemPhysChem, e202400129, 2024
2024 Activation of Cryptochrome 4 from Atlantic Herring A Frederiksen, M Aldag, IA Solov’yov, L Gerhards
Biology 13 (4), 262, 2024
2024 Avian magnetoreception: a radical sense of direction L Gerhards, PJ Hore
Quantum Effects and Measurement Techniques in Biology and Biophotonics …, 2024
2024 Structural Flexibility Slows Down Charge Transfers in Diaminoterephthalate-C60 Dyads D Timmer, G Hergert, L Gerhards, DC Lünemann, N Schröder, ...
The Journal of Physical Chemistry C, 2024
2024 Biotin-cGMP and-cAMP are able to permeate through the gap junctions of some amacrine cells in the mouse retina despite their large size C Yuan, L Gerhards, IA Solov’yov, K Dedek
Frontiers in Ophthalmology 3, 1334602, 2024
2024