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Biophysical Journal|May 6, 2010
Prediction of protein-protein interaction sites using electrostatic desolvation profilesSébastien Fiorucci, Martin ZachariasPhysical Chemistry Chemical Physics : PCCP|February 11, 2010
Simulation of DNA double-strand dissociation and formation during replica-exchange molecular dynamics simulationsSrinivasaraghavan Kannan, Martin ZachariasProteins|September 7, 2007
Protein-protein docking in CAPRI using ATTRACT to account for global and local flexibilityAndreas May, Martin ZachariasProceedings of the National Academy of Sciences of the United States of America|April 20, 2021
Accurate modeling of DNA conformational flexibility by a multivariate Ising modelKorbinian Liebl, Martin ZachariasBiophysical Journal|September 30, 2004
Conformational flexibility of the MHC class I alpha1-alpha2 domain in peptide bound and free states: a molecular dynamics simulation studyMartin Zacharias, Sebastian SpringerJournal of Computational Chemistry|October 1, 2014
Efficient calculation of relative binding free energies by umbrella sampling perturbationFabian Zeller, Martin ZachariasJournal of Computational Chemistry|December 10, 2013
Hamiltonian replica-exchange simulations with adaptive biasing of peptide backbone and side chain dihedral anglesKatja Ostermeir, 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 ZachariasPlos Computational Biology|June 8, 2021
Mechanism of collagen folding propagation studied by Molecular Dynamics simulationsJulian Hartmann, Martin ZachariasJournal of Medicinal Chemistry|June 4, 2008
Protein-ligand docking accounting for receptor side chain and global flexibility in normal modes: evaluation on kinase inhibitor cross dockingAndreas May, Martin ZachariasPageof 34