Computational assessment of select antiviral phytochemicals as potential SARS-Cov-2 main protease inhibitors: molecular dynamics guided ensemble docking and extended molecular dyna...

por Sawant, Sanjay, Patil, Rajesh, Khawate, Manoj, Zambre, Vishal, Shilimkar, Vaibhav, Jagtap, Suresh
Publicado 2021