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The Journal of Physical Chemistry. B|April 9, 2013
Scoring multipole electrostatics in condensed-phase atomistic simulationsTristan Bereau, Christian Kramer, Fabien W Monnard, et al.Chimia|December 2, 2014
Quantitative atomistic simulations of reactive and non-reactive processesMarkus MeuwlyThe Journal of Physical Chemistry. B|March 14, 2022
Atomistic Simulations for Reactions and Vibrational Spectroscopy in the Era of Machine Learning─Quo Vadis?Markus MeuwlyJournal of Chemical Information and Modeling|September 26, 2006
QSAR--how good is it in practice? Comparison of descriptor sets on an unbiased cross section of corporate data setsPeter Gedeck, Bernhard Rohde, Christian BartelsFaraday Discussions|March 31, 2012
Structural characterization of spectroscopic substates in carbonmonoxy neuroglobinStephan Lutz, Markus MeuwlyJournal of Chemical Theory and Computation|December 5, 2015
Atomistic Simulation of Adiabatic Reactive Processes Based on Multi-State Potential Energy SurfacesJonas Danielsson, Markus MeuwlyChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|May 15, 2008
Atomistic simulations of CO vibrations in ices relevant to astrochemistryNuria Plattner, Markus MeuwlyPageof 34