Journal of Computer-Aided Molecular Design · 2019 · 33 citations · 60 references
Life SciencesBioinformaticsChemistryCrystal StructureStructural BioinformaticsStructural BiologyBinding AffinityBinding Affinity PredictionLigand BindingMolecular DockingProtein-ligand DockingReceptor BindingLigand Binding AffinityProtein - Ligand Affinity PredictionProtein-ligand Binding Affinity PredictionReceptor Affinity PredictionStructure-based Binding Prediction
60
Helen M. Berman · Nucleic Acids Research · 2000 · 39.8K citations
Molecular dynamics with coupling to an external bath
Herman J. C. Berendsen, Johan P. M. Postma, Wilfred F. van Gunsteren et al. · The Journal of Chemical Physics · 1984 · 31K citations · Full text
Natural Sciences, Chemistry, Physics +17
Development and testing of a general amber force field
Junmei Wang, Romain M. Wolf, James W. Caldwell et al. · Journal of Computational Chemistry · 2004 · 19.6K citations