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Applications of density functional theory in COVID-19 drug modeling

The rapidly evolving Coronavirus 2019 (COVID-19) pandemic has led to millions of deaths around the world, highlighting the pressing need to develop effective antiviral pharmaceuticals. Recent efforts with computer-aided rational drug discovery have allowed detailed examination of drug–macromolecule...

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Detalles Bibliográficos
Autores principales: Ye, Naike, Yang, Zekai, Liu, Yuchen
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier Ltd. 2022
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8695517/
https://www.ncbi.nlm.nih.gov/pubmed/34954327
http://dx.doi.org/10.1016/j.drudis.2021.12.017