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Computational investigation on the antioxidant activities and on the M(pro) SARS-CoV-2 non-covalent inhibition of isorhamnetin

In the present work, we report a computational study on some important chemical properties of the flavonoid isorhamnetin, used in traditional medicine in many countries. In the course of the study we determined the acid-base equilibria in aqueous solution, the possible reaction pathways with the •OO...

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Detalles Bibliográficos
Autores principales: Spiegel, Maciej, Ciardullo, Giada, Marino, Tiziana, Russo, Nino
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2023
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9902383/
https://www.ncbi.nlm.nih.gov/pubmed/36762196
http://dx.doi.org/10.3389/fchem.2023.1122880