Publications

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“Protonation Effects in Protein-Ligand Complexes – A Case Study of Endothiapepsin and Pepstatin A with Computational and Experimental Methods“
H. Vatheuer, O. Palomino-Hernández, J. Müller, P. Galonska, S. Glinca, P. Czodrowski; ChemMedChem 2025, e202400953, doi: 10.1002/cmdc.202400953

“The C-terminal α-helix is crucial for the activity of the bacterial ABC transporter BmrA”
V. Osten, K. Oepen, D. Schneider, Journal of Biological Chemistry, 301 (2), 2025, 108098, doi: 10.1016/j.jbc.2024.108098.

“Dual Centrifugation-Based Screening for pH-Responsive Liposomes”
L. Gleue, B. Graefen, M. Voigt, J. Schupp, D. Schneider, M. Fichter, M. Kuske, V. Mailaender, A. Tuettenberg, M. Helm;
ChemMedChem 2025, 20, e202400648. doi: 10.1002/cmdc.202400648

“Photocyclization of Fluorinated Acetophenones Unlocks an Efficient Way to Solar Energy Storage”
H. Maag, M. Schmitz, A. Sandvoß, D. Mundil, A. Pedada, F. Glaser, C. Kerzig, and J. M. Wahl;
J. Am. Chem. Soc. 2024, 146, 47, 32701–32707, doi: 10.1021/jacs.4c12249

“Structural basis for GTPase activity and conformational changes of the bacterial dynamin-like protein SynDLP”
B. Junglas, L. Gewehr, L. Mernberger, P. Schönnenbeck, R. Jilly, N. Hellmann, D. Schneider, C. Sachse;
Cell Reports, 43 (9), 2024, 114657, doi: 10.1016/j.celrep.2024.114657.

“Enzymatic Reaction Network-driven Polymerization-induced Transient Coacervation”
S. Sharma, A. Belluati, M. Kumar, S. Dhiman, Angew. Chem. Int. Ed. 2024, e202421620

“Design and characterisation of casein coated and drug loaded magnetic nanoparticles for theranostic applications”
C. Wenck, N. Meier, E. Heinrich, V. Grützner, F. Wiekhorst, and R. Bleul; RSC Adv., 2024, 14, 26388-26399; doi:10.1039/D4RA02626H

“Fuel-Driven Enzymatic Reaction Networks to Program Autonomous Thiol/Disulfide Redox Systems”
A. Sarkar, B. Dúzs, and A.Walther; J. Am. Chem. Soc. 2024, 146, 15, 10281–10285; doi:10.1021/jacs.4c02680

“Near zero-field microwave-free magnetometry with ensembles of nitrogen-vacancy centers in diamond”
O. Dhungel, T.Lenz, M. Omar, J. S. Rebeirro, M.-T. Luu, A.T. Younesi, R. Ulbricht, V. Ivády, A. Gali, A. Wickenbrock, and D. Budker
Phys. Rev. B 109, 224107, 2024; doi:10.1103/PhysRevB.109.224107

“Deep Learning Reaction Network: a machine learning framework for modeling time resolved data”
N. Alagna, B. Dúzs, H. Köppl,  A. Walther, and S. Gerber; bioRxiv 2024.07.31.606055; doi: 10.1101/2024.07.31.606055

“An Efficient and Accurate SCF Algorithm for Block Copolymer Films and Brushes Using Adaptive Discretizations”

“Stability and Elasticity of Ultrathin Sphere-Patterned Block Copolymer Films”
L. Qiao, D. A. Vega, and F. Schmid; Macromolecules 2024, 57, 9, 4629–4634

“Near-zero-field microwave-free magnetometry with nitrogen-vacancy centers in nanodiamonds”
O. Dhungel, M. Mrózek, T. Lenz, V. Ivády, A. Gali, A. Wickenbrock, D. Budker, W. Gawlik, and A. M. Wojciechowski
Optics Express, Vol. 32, Issue 12, pp. 21936-21945 (2024), doi: 10.1364/OE.521124