Sterenin M as a potential inhibitor of SARS-CoV-2 main protease identified from MeFSAT database using molecular docking, molecular dynamics simulation and binding free energy calculation

The disease outbreak of Coronavirus disease-19 (COVID-19), caused by the novel SARS-CoV-2 virus, remains a public health concern. COVID-19 is spreading rapidly with a high mortality rate due to unavailability of effective treatment or vaccine for the disease. The high rate of mutation and recombinat...

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Detalles Bibliográficos
Autores principales: Prajapati, Jignesh, Patel, Rohit, Goswami, Dweipayan, Saraf, Meenu, Rawal, Rakesh M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier Ltd. 2021
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8195690/
https://www.ncbi.nlm.nih.gov/pubmed/34174757
http://dx.doi.org/10.1016/j.compbiomed.2021.104568

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8195690/
https://www.ncbi.nlm.nih.gov/pubmed/34174757
http://dx.doi.org/10.1016/j.compbiomed.2021.104568

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