Identification of secondary metabolites from Crescentia cujete as promising antibacterial therapeutics targeting type 2A topoisomerases through molecular dynamics simulation
Jamiu Olaseni Aribisala, Rukayat Abiola Abdulsalam, Yamkela Dweba, Madonsela Khumbulani, Saheed Sabiu
Topics & Concepts
DNA gyraseTopoisomeraseTopoisomerase IVMolecular dynamicsChemistryIn silicoDNADocking (animal)BiochemistryStereochemistryLipinski's rule of fiveDNA supercoilEscherichia coliDNA replicationComputational chemistryMedicineGeneNursingCancer therapeutics and mechanismsPharmacological Effects of Natural CompoundsBioactive Compounds and Antitumor Agents