In silico screening, ADMET analysis and MD simulations of phytochemicals of Onosma bracteata Wall. as SARS CoV-2 inhibitors
Udaykumar G. Vegad, Normi D. Gajjar, Prinsa R. Nagar, Sanjay Chauhan, Devang J. Pandya, Tejas M. Dhameliya
Topics & Concepts
In silicoVirtual screeningSevere acute respiratory syndrome coronavirus 2 (SARS-CoV-2)Human immunodeficiency virus (HIV)Lipinski's rule of fiveBiologyCoronavirus disease 2019 (COVID-19)Traditional medicineComputational biologyVirologyPharmacologyMedicineBioinformaticsDrug discoveryBiochemistryInfectious disease (medical specialty)PathologyGeneDiseaseComputational Drug Discovery MethodsDiverse Scientific Research StudiesDrug-Induced Hepatotoxicity and Protection