Haste makes waste: A critical review of docking‐based virtual screening in drug repurposing for SARS‐CoV‐2 main protease (M‐pro) inhibition

This review makes a critical evaluation of 61 peer‐reviewed manuscripts that use a docking step in a virtual screening (VS) protocol to predict SARS‐CoV‐2 M‐pro (M‐pro) inhibitors in approved or investigational drugs. Various manuscripts predict different compounds, even when they use a similar init...

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Detalles Bibliográficos
Autores principales: Macip, Guillem, Garcia‐Segura, Pol, Mestres‐Truyol, Júlia, Saldivar‐Espinoza, Bryan, Ojeda‐Montes, María José, Gimeno, Aleix, Cereto‐Massagué, Adrià, Garcia‐Vallvé, Santiago, Pujadas, Gerard
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2021
Materias:
Review Articles
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8662214/
https://www.ncbi.nlm.nih.gov/pubmed/34697818
http://dx.doi.org/10.1002/med.21862

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8662214/
https://www.ncbi.nlm.nih.gov/pubmed/34697818
http://dx.doi.org/10.1002/med.21862

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