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Journal of Chemical Information and Modeling|May 27, 2014
Protein-ligand docking using hamiltonian replica exchange simulations with soft core potentialsManuel P Luitz, Martin ZachariasProteins|October 17, 2012
Role of tyrosine hot-spot residues at the interface of colicin E9 and immunity protein 9: a comparative free energy simulation studyManuel P Luitz, Martin ZachariasThe Journal of Physical Chemistry. B|April 8, 2016
Mechanism of pKID/KIX Association Studied by Molecular Dynamics Free Energy SimulationsRainer Bomblies, Manuel P Luitz, Martin ZachariasThe Journal of Physical Chemistry. B|November 5, 2016
Molecular Dynamics Analysis of 4E-BP2 Protein Fold Stabilization Induced by PhosphorylationRainer Bomblies, Manuel P Luitz, Martin ZachariasBiophysical Journal|October 6, 2017
Comparative Molecular Dynamics Analysis of RNase-S Complex FormationManuel P Luitz, Rainer Bomblies, 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.Scientific Reports|January 29, 2016
Adenylylation of Tyr77 stabilizes Rab1b GTPase in an active state: A molecular dynamics simulation analysisManuel P Luitz, Rainer Bomblies, Evelyn Ramcke, et al.Plos One|May 26, 2017
Covalent dye attachment influences the dynamics and conformational properties of flexible peptidesManuel P Luitz, Anders Barth, Alvaro H Crevenna, et al.Pageof 1