ArticleStructural chemistry2022
Interactions between favipiravir and a BNC cage towards drug delivery applications.
Article in Structural chemistry, 2022. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 1 paper.
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The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.
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Who cites it
1 citing paper in PubMed.
- Metal-decorated graphdiyne nanocarriers for favipiravir delivery: a DFT investigation.Nanoscale advances · 2026Article
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2 authors.
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Abstract
Electronic structure analysis of bimolecular formation of favipiravir (Fav) and a representative model of boron-nitrogen-carbon (BNC) cage was performed in this work for providing more insightful information regarding the drug delivery purposes by the importance of Fav drug for medication of COVID-19. To achieve the purpose of this work, density functional theory (DFT) calculations were carried out to obtain the stabilized structures and corresponding molecular and atomic scale descriptors. Six models of BNC-Fav complexes were obtained reading the participation of different atomic positions of Fav to interactions with the BNC cage surface. The results yielded BNC-Fav2 at the highest strength and BNC-Fav4 at the lowest strength of bimolecular formations. Molecular orbital-related features and atomic scale quadrupole coping constants all revealed that BNC-Fav2 complex could be proposed for employing in drug delivery process by managing the loaded Fav contribution to future interactions.
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