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Density functional theory study of the local molecular properties of acetamide derivatives as anti-HIV drugs

Accurate quantum chemical computations based on density functional theory (DFT) were performed on the series of 2-(4-(naphthalen-2-yl)-1,2,3-thiadiazol-5-ylthio)-N-acetamide (TTA) derivatives. The local reactivity of the acetamide derivatives as anti-HIV drugs were studied in terms of Fukui function...

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Detalles Bibliográficos
Autores principales: Oftadeh, M., Mahani, N. Madadi, Hamadanian, M.
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Medknow Publications & Media Pvt Ltd 2013
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3757594/
https://www.ncbi.nlm.nih.gov/pubmed/24082898