Advances to tackle backbone flexibility in protein docking
Ameya Harmalkar, Jeffrey J. Gray
Topics & Concepts
Docking (animal)Computer scienceFlexibility (engineering)Molecular dynamicsProtein–ligand dockingForce field (fiction)Artificial intelligenceMachine learningChemistryComputational chemistryVirtual screeningMathematicsNursingMedicineStatisticsProtein Structure and DynamicsComputational Drug Discovery MethodsEnzyme Structure and Function