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In Silico Drug Repositioning to Target the SARS-CoV-2 Main Protease as Covalent Inhibitors Employing a Combined Structure-Based Virtual Screening Strategy of Pharmacophore Models and Covalent Docking
The epidemic caused by the SARS-CoV-2 coronavirus, which has spread rapidly throughout the world, requires urgent and effective treatments considering that the appearance of viral variants limits the efficacy of vaccines. The main protease of SARS-CoV-2 (M(pro)) is a highly conserved cysteine protei...
Autores principales: | Vázquez-Mendoza, Luis Heriberto, Mendoza-Figueroa, Humberto L., García-Vázquez, Juan Benjamín, Correa-Basurto, José, García-Machorro, Jazmín |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8999907/ https://www.ncbi.nlm.nih.gov/pubmed/35409348 http://dx.doi.org/10.3390/ijms23073987 |
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