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Identification of Food Compounds as inhibitors of SARS-CoV-2 main protease using molecular docking and molecular dynamics simulations

SARS-CoV-2 has rapidly emerged as a global pandemic with high infection rate. At present, there is no drug available for this deadly disease. Recently, M(pro) (Main Protease) enzyme has been identified as essential proteins for the survival of this virus. In the present work, Lipinski's rules a...

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Detalles Bibliográficos
Autores principales: Masand, Vijay H., Sk, Md Fulbabu, Kar, Parimal, Rastija, Vesna, Zaki, Magdi E.A.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier B.V. 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8295492/
https://www.ncbi.nlm.nih.gov/pubmed/34312571
http://dx.doi.org/10.1016/j.chemolab.2021.104394