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Elucidation of cryptic and allosteric pockets within the SARS-CoV-2 protease

The SARS-CoV-2 pandemic has rapidly spread across the globe, posing an urgent health concern. Many quests to computationally identify treatments against the virus rely on in silico small molecule docking to experimentally determined structures of viral proteins. One limit to these approaches is that...

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Detalles Bibliográficos
Autores principales: Sztain, Terra, Amaro, Rommie, McCammon, J. Andrew
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Cold Spring Harbor Laboratory 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7386507/
https://www.ncbi.nlm.nih.gov/pubmed/32743587
http://dx.doi.org/10.1101/2020.07.23.218784