Showing results (1-10 of 11) with videos related to
Sort By:
Pageof 2
Biochimica Et Biophysica Acta|January 10, 2013
Advanced replica-exchange sampling to study the flexibility and plasticity of peptides and proteinsKatja Ostermeir, 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 ZachariasProteins|September 23, 2014
Hamiltonian replica exchange combined with elastic network analysis to enhance global domain motions in atomistic molecular dynamics simulationsKatja Ostermeir, Martin ZachariasThe Journal of Physical Chemistry. B|August 28, 2014
Rapid alchemical free energy calculation employing a generalized born implicit solvent modelKatja Ostermeir, Martin ZachariasPlos One|February 17, 2017
Accelerated flexible protein-ligand docking using Hamiltonian replica exchange with a repulsive biasing potentialKatja Ostermeir, Martin ZachariasMolecular Immunology|August 23, 2014
Coupling between side chain interactions and binding pocket flexibility in HLA-B*44:02 molecules investigated by molecular dynamics simulationsKatja Ostermeir, Sebastian Springer, Martin ZachariasFrontiers in Molecular Biosciences|November 5, 2019
Global Dynamics of Yeast Hsp90 Middle and C-Terminal Dimer Studied by Advanced Sampling SimulationsFlorian Kandzia, Katja Ostermeir, Martin ZachariasPhysical Review. E, Statistical, Nonlinear, and Soft Matter Physics|September 28, 2010
Buckling of stiff polymer rings in weak spherical confinementKatja Ostermeir, Karen Alim, Erwin FreyJournal of Physics. Condensed Matter : an Institute of Physics Journal|July 22, 2015
Exploring biomolecular dynamics and interactions using advanced sampling methodsManuel Luitz, Rainer Bomblies, Katja Ostermeir, et al.The Journal of Physical Chemistry. B|April 11, 2020
Quantum Chemical Calculation of Molecular and Periodic Peptide and Protein StructuresSarah Schmitz, Jakob Seibert, Katja Ostermeir, et al.Pageof 2