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Science (New York, N.Y.)|August 9, 2008
Large-scale molecular dynamics simulations of self-assembling systemsMichael L Klein, Wataru ShinodaJournal of the American Chemical Society|October 19, 2006
Reorganization free energies for long-range electron transfer in a porphyrin-binding four-helix bundle proteinJochen Blumberger, Michael L KleinChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|November 13, 2004
On the quantum nature of an excess proton in liquid hydrogen fluorideSimone Raugei, Michael L KleinThe Journal of Physical Chemistry Letters|August 28, 2024
Understanding Strain and Failure of a Knot in Polyethylene Using Molecular Dynamics with Machine-Learned PotentialsMark DelloStritto, Michael L KleinCurrent Opinion in Structural Biology|April 1, 2017
Small molecule modulation of voltage gated sodium channelsVincenzo Carnevale, Michael L KleinJournal of the American Chemical Society|March 18, 2005
Dynamical flexibility and proton transfer in the arginase active site probed by ab initio molecular dynamicsIvaylo Ivanov, Michael L KleinChemphyschem : a European Journal of Chemical Physics and Physical Chemistry|February 4, 2005
Ab initio molecular dynamics simulation of a water-hydrogen fluoride equimolar mixtureChristian Simon, Michael L KleinPlos One|November 25, 2015
Positive Allosteric Modulation of Kv Channels by Sevoflurane: Insights into the Structural Basis of Inhaled Anesthetic ActionQiansheng Liang, Warren D Anderson, Shelly T Jones, et al.The Journal of Physical Chemistry. B|July 4, 2019
Halogen Bond Structure and Dynamics from Molecular SimulationsRichard C Remsing, Michael L KleinPhysical Chemistry Chemical Physics : PCCP|May 5, 2017
Probing the dynamics of N-methylacetamide in methanol via ab initio molecular dynamicsVivek K Yadav, Michael L KleinPageof 39