Molecular docking evaluation of celecoxib on the boron nitride nanostructures for alleviation of cardiovascular risk and inflammatory

Celecoxib (CXB) is a nonsteroidal anti-inflammatory drug (NSAID) that can be used to treat rheumatoid arthritis and ischemic heart disease. In this research, density functional theory (DFT) and molecular docking simulations were performed to study the interaction of boron nitride nanotube (BNNT) and...

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Autores principales: Yan Cao, Malihe Noori, Marziyeh Nazari, Andrew Ng Kay Lup, Alireza Soltani, Vahid Erfani-Moghadam, Aref Salehi, Mehrdad Aghaei, Md Lutfor Rahman, Mohd Sani Sarjadi, Shaheen M. Sarkar, Chia-Hung Su
Formato: article
Lenguaje:EN
Publicado: Elsevier 2022
Materias:
DFT
Acceso en línea:https://doaj.org/article/d7624cd559784ef58380ea711bedf14a
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