A dispersion-corrected DFT calculation on encapsulation of favipiravir drug used as antiviral against COVID-19 into carbon-, boron-, and aluminum-nitride nanotubes for optimal drug delivery systems combined with molecular docking simulations

Favipiravir (FAV) (6-fluoro-3-oxo-3,4-dihydropyrazine-2-carboxamide) is one of the most effective antiviral drugs which is cited for action against RNA-viral infections of COVID-19. In this study, density functional theory (DFT) calculations were used to investigate three nanotubes (NTs) with FAV dr...

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Detalles Bibliográficos
Autores principales: Albarakati, Roqaya, Al-Qurashi, Ohoud, Safi, Zaki, Wazzan, Nuha
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer US 2023
Materias:
Research
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10173244/
https://www.ncbi.nlm.nih.gov/pubmed/37363043
http://dx.doi.org/10.1007/s11224-023-02182-4

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10173244/
https://www.ncbi.nlm.nih.gov/pubmed/37363043
http://dx.doi.org/10.1007/s11224-023-02182-4

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