Surface Science · 2013 · 18 citations · 43 references
Natural SciencesBiophysicsChemistryMolecular BiophysicsStructural BiologyStructural BiophysicsHydration EffectsIntermolecular ForcesLigand BindingPeptide Bond ChemistryPeptide ChemistryWater ChemistryWater Structure PerturbationWater-mediated DockingWater-mediated Interactions In Receptors
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VMD: Visual molecular dynamics
William Humphrey, Andrew Dalke, Klaus Schulten · Journal of Molecular Graphics · 1996 · 66.6K citations
Molecular dynamics with coupling to an external bath
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Natural Sciences, Chemistry, Physics +17