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Identification of potential plant-based inhibitor against viral proteases of SARS-CoV-2 through molecular docking, MM-PBSA binding energy calculations and molecular dynamics simulation

The Coronavirus disease 2019 (COVID-19), caused by the novel coronavirus, SARS-CoV-2, has recently emerged as a pandemic. Here, an attempt has been made through in-silico high throughput screening to explore the antiviral compounds from traditionally used plants for antiviral treatments in India nam...

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Detalles Bibliográficos
Autores principales: Gogoi, Bhaskarjyoti, Chowdhury, Purvita, Goswami, Nabajyoti, Gogoi, Neelutpal, Naiya, Tufan, Chetia, Pankaj, Mahanta, Saurov, Chetia, Dipak, Tanti, Bhaben, Borah, Probodh, Handique, Pratap Jyoti
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer International Publishing 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8047602/
https://www.ncbi.nlm.nih.gov/pubmed/33856591
http://dx.doi.org/10.1007/s11030-021-10211-9