Use of Molecular Docking as a Decision-Making Tool in Drug Discovery
Azizeh Abdolmaleki, Fereshteh Shiri, Jahan B. Ghasemi
Topics & Concepts
PharmacophoreDocking (animal)Protein–ligand dockingComputer scienceMolecular dynamicsDrug discoveryvan der Waals forceComputational biologyChemistryComputational chemistryVirtual screeningStereochemistryMoleculeBiologyBiochemistryOrganic chemistryMedicineNursingComputational Drug Discovery MethodsProtein Structure and DynamicsReceptor Mechanisms and Signaling