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Journal of Computational Chemistry|October 1, 2014
Efficient calculation of relative binding free energies by umbrella sampling perturbationFabian Zeller, Martin ZachariasThe Journal of Physical Chemistry. B|June 19, 2014
Evaluation of Generalized Born Model Accuracy for Absolute Binding Free Energy CalculationsFabian Zeller, Martin ZachariasBiophysical Journal|November 5, 2015
Substrate Binding Specifically Modulates Domain Arrangements in Adenylate KinaseFabian Zeller, Martin ZachariasJournal of Chemical Theory and Computation|May 10, 2017
Thermodynamics and Kinetics of Nucleobase Stacking Oligomerization Revealed by Molecular Dynamics SimulationsFabian Zeller, Martin ZachariasJournal of Chemical Theory and Computation|November 19, 2015
Adaptive Biasing Combined with Hamiltonian Replica Exchange to Improve Umbrella Sampling Free Energy SimulationsFabian Zeller, Martin ZachariasJournal of Chemical Theory and Computation|August 19, 2017
Multiscale Simulation of Receptor-Drug Association Kinetics: Application to Neuraminidase InhibitorsFabian Zeller, Manuel P Luitz, Rainer Bomblies, et al.Nature Communications|February 25, 2016
Subnanometre enzyme mechanics probed by single-molecule force spectroscopyBenjamin Pelz, Gabriel Žoldák, Fabian Zeller, et al.Pageof 1