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When Virtual Screening Yields Inactive Drugs: Dealing with False Theoretical Friends

The search of antivirals against SARS‐CoV‐2 in available libraries of compounds was initiated as soon as WHO announced that the coronavirus outbreak became a pandemic. That pivotal task has been conducted by both experimental groups in wet‐labs as well as by theoretical chemists in supercomputing ce...

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Detalles Bibliográficos
Autor principal: Cerón‐Carrasco, José P.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: John Wiley and Sons Inc. 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9542010/
https://www.ncbi.nlm.nih.gov/pubmed/35726731
http://dx.doi.org/10.1002/cmdc.202200278