Discovery of Novel and Highly Potent Inhibitors of SARS CoV-2 Papain-Like Protease Through Structure-Based Pharmacophore Modeling, Virtual Screening, Molecular Docking, Molecular Dynamics Simulations, and Biological Evaluation

Background and Objective: COVID-19 has struck our society as a great calamity, and the need for effective anti-viral drugs is more urgent than ever. Papain-like protease (PLpro) of SARS CoV-2 plays important roles in virus maturation, dysregulation of host inflammation, and antiviral immune response...

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Detalles Bibliográficos
Autores principales: Tian, Xiaoyan, Zhao, Quanfeng, Chen, Xiaohong, Peng, Zhe, Tan, Xiaodan, Wang, Qin, Chen, Lin, Yang, Yang
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2022
Materias:
Pharmacology
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8899470/
https://www.ncbi.nlm.nih.gov/pubmed/35264955
http://dx.doi.org/10.3389/fphar.2022.817715

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8899470/
https://www.ncbi.nlm.nih.gov/pubmed/35264955
http://dx.doi.org/10.3389/fphar.2022.817715

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