The anti-SARS-CoV-2 activity of novel 9, 10-dihydrophenanthrene derivatives: an insight into molecular docking, ADMET analysis, and molecular dynamics simulation

Originating in Wuhan, the COVID-19 pandemic wave has had a profound impact on the global healthcare system. In this study, we used a 2D QSAR technique, ADMET analysis, molecular docking, and dynamic simulations to sort and evaluate the performance of thirty-nine bioactive analogues of 9,10-dihydroph...

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Detalles Bibliográficos
Autores principales: Yamari, Imane, Abchir, Oussama, Mali, Suraj N., Errougui, Abdelkbir, Talbi, Mohammed, Kouali, Mhammed El, Chtita, Samir
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Authors. Published by Elsevier B.V. 2023
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10260260/
https://www.ncbi.nlm.nih.gov/pubmed/37332393
http://dx.doi.org/10.1016/j.sciaf.2023.e01754

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10260260/
https://www.ncbi.nlm.nih.gov/pubmed/37332393
http://dx.doi.org/10.1016/j.sciaf.2023.e01754

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