Molecular Dynamics Simulation: Methods and Application
Sakshi Singh, Vinay Kumar Singh
Topics & Concepts
Molecular dynamicsDocking (animal)Protein–ligand dockingProtein ligandForce field (fiction)Computer scienceChemistryLigand (biochemistry)Protein structureBiological systemBiophysicsComputational biologyChemical physicsComputational chemistryBiologyBiochemistryVirtual screeningArtificial intelligenceMedicineNursingReceptorProtein Structure and DynamicsEnzyme Structure and FunctionRNA and protein synthesis mechanisms