Identification of anti-mycobacterial agents against mmpL3: Virtual screening, ADMET analysis and MD simulations
Kaushikkumar A. Bhakhar, Normi D. Gajjar, Kunjan B. Bodiwala, Dipen K. Sureja, Tejas M. Dhameliya
Topics & Concepts
Virtual screeningChemistryPharmacophoreIn silicoLipinski's rule of fiveMycobacterium tuberculosisComputational biologyStereochemistryCombinatorial chemistryTuberculosisBiochemistryGeneBiologyMedicinePathologyTuberculosis Research and EpidemiologyComputational Drug Discovery MethodsCancer therapeutics and mechanisms