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Exploring the Binding Effects of Natural Products and Antihypertensive Drugs on SARS-CoV-2: An In Silico Investigation of Main Protease and Spike Protein

In this in silico study, we conducted an in-depth exploration of the potential of natural products and antihypertensive molecules that could serve as inhibitors targeting the key proteins of the SARS-CoV-2 virus: the main protease (Mpro) and the spike (S) protein. By utilizing Induced Fit Docking (I...

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Detalles Bibliográficos
Autores principales: Moschovou, Kalliopi, Antoniou, Maria, Chontzopoulou, Eleni, Papavasileiou, Konstantinos D., Melagraki, Georgia, Afantitis, Antreas, Mavromoustakos, Thomas
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10649947/
https://www.ncbi.nlm.nih.gov/pubmed/37958877
http://dx.doi.org/10.3390/ijms242115894