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Journal of Chemical Theory and Computation|January 31, 2019
Evaluation of Predicted Protein-Protein Complexes by Binding Free Energy SimulationsTill Siebenmorgen, Martin ZachariasBiophysical Journal|June 8, 2017
Origin of Ion Specificity of Telomeric DNA G-Quadruplexes Investigated by Free-Energy SimulationsTill Siebenmorgen, Martin ZachariasJournal of Chemical Information and Modeling|October 19, 2020
Efficient Refinement and Free Energy Scoring of Predicted Protein-Protein Complexes Using Replica Exchange with Repulsive ScalingTill Siebenmorgen, Martin ZachariasJournal of Computational Chemistry|March 10, 2020
Prediction of protein-protein complexes using replica exchange with repulsive scalingTill Siebenmorgen, Michael Engelhard, Martin ZachariasMethods in Molecular Biology (Clifton, N.J.)|July 10, 2024
Refinement of Docked Protein-Protein Complexes Using Repulsive Scaling Replica Exchange SimulationsTill Siebenmorgen, Yasmin Saremi Nanji, Martin ZachariasJournal of Computational Chemistry|July 7, 2022
Explicit solvent repulsive scaling replica exchange molecular dynamics (RS-REMD) in molecular modeling of protein-glycosaminoglycan complexesMateusz Marcisz, Margrethe Gaardløs, Krzysztof K Bojarski, et al.Journal of Agricultural and Food Chemistry|May 31, 2025
Enhancing Catalytic Activity of a Baeyer-Villiger monooxygenase from <i>Oceanicola granulosus</i>: Simultaneous Engineering of the Distal Site and Active SiteYu Du, Xiang Lv, Till Siebenmorgen, et al.Journal of Computational Chemistry|March 26, 2021
Evaluation of replica exchange with repulsive scaling approach for docking glycosaminoglycansMartyna Maszota-Zieleniak, Mateusz Marcisz, Małgorzata M Kogut, et al.Communications Biology|April 8, 2023
Extrinsic stabilization of antiviral ACE2-Fc fusion proteins targeting SARS-CoV-2Hristo L Svilenov, Florent Delhommel, Till Siebenmorgen, et al.Scientific Reports|August 29, 2022
Small molecule mediated inhibition of protein cargo recognition by peroxisomal transport receptor PEX5 is toxic to TrypanosomaValeria Napolitano, Charlotte A Softley, Artur Blat, et al.Pageof 2