Screening of potential drug from Azadirachta Indica (Neem) extracts for SARS-CoV-2: An insight from molecular docking and MD-simulation studies
Nabajyoti Baildya, Abdul Ashik Khan, Narendra Nath Ghosh, Tanmoy Dutta, Asoke P. Chattopadhyay
Topics & Concepts
AzadirachtaChemistryDocking (animal)Radius of gyrationTraditional medicineMolecular dynamicsProteaseStereochemistryBiochemistryEnzymeVeterinary medicineOrganic chemistryComputational chemistryMedicinePolymerInsect Pest Control StrategiesComputational Drug Discovery MethodsDiverse Scientific Research Studies