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The Journal of Chemical Physics|January 21, 2014
The effect of classical and quantum dynamics on vibrational frequency shifts of H2 in clathrate hydratesNuria Plattner, Markus MeuwlyThe Journal of Chemical Physics|September 17, 2015
Reproducing kernel potential energy surfaces in biomolecular simulations: Nitric oxide binding to myoglobinMaksym Soloviov, Markus MeuwlyPhysical Chemistry Chemical Physics : PCCP|July 19, 2022
Correction: Transfer learned potential energy surfaces: accurate anharmonic vibrational dynamics and dissociation energies for the formic acid monomer and dimerSilvan Käser, Markus MeuwlyCurrent Opinion in Drug Discovery & Development|July 5, 2008
Exploiting QSAR models in lead optimizationPeter Gedeck, Richard A LewisThe Journal of Physical Chemistry. A|May 6, 2011
On the role of nonbonded interactions in vibrational energy relaxation of cyanide in waterMyung Won Lee, Markus MeuwlyBiophysical Journal|December 4, 2003
Theoretical investigation of infrared spectra and pocket dynamics of photodissociated carbonmonoxy myoglobinDavid R Nutt, Markus MeuwlyBiophysical Journal|December 6, 2005
Studying reactive processes with classical dynamics: rebinding dynamics in MbNODavid R Nutt, Markus MeuwlyThe Journal of Chemical Physics|July 2, 2018
A reactive, scalable, and transferable model for molecular energies from a neural network approach based on local informationOliver T Unke, Markus MeuwlyChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|March 3, 2007
Ferric and ferrous iron in nitroso-myoglobin: computer simulations of stable and metastable States and their infrared spectraDavid R Nutt, Markus MeuwlyFaraday Discussions|March 20, 2014
Dynamics and vibrational spectroscopy of water at hydroxylated silica surfacesPrashant Kumar Gupta, Markus MeuwlyPageof 34