Small-Molecule Library Screening by Docking with PyRx
Sargis Dallakyan, Arthur J. Olson
Topics & Concepts
DOCKVirtual screeningDocking (animal)Computer scienceIn silicoOpen sourceSmall moleculeSoftwareOperating systemDrug discoveryBioinformaticsChemistryBiologyBiochemistryMedicineNursingGeneComputational Drug Discovery MethodsProtein Structure and DynamicsGenetics, Bioinformatics, and Biomedical Research