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Identification of 4-acrylamido-N-(pyridazin-3-yl)benzamide as anti-COVID-19 compound: a DFTB, molecular docking, and molecular dynamics study

Omicron is one of the variants of COVID-19 and continuing member of a pandemic. There are several types of vaccines that were developed around the globe to fight against the virus. However, the world is suffering to find suitable drug candidates for the virus. The main protease (M(pro)) enzyme of th...

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Detalles Bibliográficos
Autores principales: Sepay, Nayim, Chakrabarti, Sukanya, Afzal, Mohd, Alarifi, Abdullah, Mal, Dasarath
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9403657/
https://www.ncbi.nlm.nih.gov/pubmed/36128538
http://dx.doi.org/10.1039/d2ra04333e

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