ACS Omega · 2022 · 66 citations · 81 references
Natural SciencesChemistryMedicinal ChemistryComputational ChemistryInorganic ChemistryStructure-activity RelationshipsCoordination ChemistryLigand BindingMetal-ligand BondingMolecular DockingTransition Metal ChemistryTransition Metal ComplexesBidentate Ligand BindingComplexation ChemistryIntermolecular Metal-ligand InteractionsMass Spectral Data AnalysisMetal-ligand Bonding AnalysisMolecular Docking AnalysisSpectroscopic Characterization Of Metal-ligand BondsVisible Spectroscopy
molecular docking results also strongly support the experimental results.
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Density-functional thermochemistry. III. The role of exact exchange
Axel D. Becke · The Journal of Chemical Physics · 1993 · 102.8K citations
Natural Sciences, Chemistry, Physics +13