Ontology highlight
ABSTRACT:
SUBMITTER: Sharma S
PROVIDER: S-EPMC7678360 | biostudies-literature | 2022 Apr
REPOSITORIES: biostudies-literature
Sharma Shilpa S Deep Shashank S
Journal of biomolecular structure & dynamics 20201112 7
COVID-19, caused by novel coronavirus or SARS-CoV-2, is a viral disease which has infected millions worldwide. Considering the urgent need of the drug for fighting against this infectious disease, we have performed in-silico drug repurposing followed by molecular dynamics (MD) simulation and MM-GBSA calculation. The main protease (M<sup>pro</sup>) is one of the best-characterized drug targets among coronaviruses, therefore, this was screened for already known FDA approved drugs and some natural ...[more]