Bioorganic & Medicinal Chemistry Letters · 2010 · 25 citations · 24 references
MedicineMedicinal ChemistryPharmacologyDrug DiscoveryMetabolismMolecular PharmacologyCytochrome P450 EnzymesDrug-metabolizing EnzymesEnzyme InhibitionEnzyme KineticsMolecular DockingMolecular DynamicsBinding Kinetics AnalysisCyp1a2 Drug MetabolismCytochrome P450 1A2Cytochrome P450 Drug MetabolismCytochrome P450 Enzyme ActivityCytochrome P450 Enzyme InhibitionCytochrome P450 InhibitionCytochrome P450 Kinetics
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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