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Identification of natural compounds as SARS-CoV-2 inhibitors via molecular docking and molecular dynamic simulation

BACKGROUND: Base mutations increase the contagiousness and transmissibility of the Delta and Lambda strains and lead to the severity of the COVID-19 pandemic. Molecular docking and molecular dynamics (MD) simulations are frequently used for drug discovery and relocation. Small molecular compounds fr...

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Detalles Bibliográficos
Autores principales:	Han, Tiantian, Luo, Ziqing, Ji, Lichun, Wu, Peng, Li, Geng, Liu, Xiaohong, Lai, Yanni
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Frontiers Media S.A. 2023
Materias:	Microbiology
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9930647/ https://www.ncbi.nlm.nih.gov/pubmed/36817101 http://dx.doi.org/10.3389/fmicb.2022.1095068

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