Non-competitive interactions between hydroxychloroquine and azithromycin: Systematic density functional, molecular dynamics, and docking calculations

In this study, density functional theory (DFT) and docking calculations were systematically performed to study the non-competitive interaction between Hydroxychloroquine (HCQ) and azithromycin (AZTH). The calculated changes in Gibbs free energy and enthalpy (at 310 K) were positive, indicating the n...

Descripción completa

Detalles Bibliográficos
Autores principales: Khalafalla, Mohammed A.H., Hadj Belgacem, Chokri, Abdelrehim, Ismail, Chaieb, Kamel
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Elsevier B.V. 2021
Materias:
Research Paper
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8129801/
https://www.ncbi.nlm.nih.gov/pubmed/34024911
http://dx.doi.org/10.1016/j.cplett.2021.138745

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8129801/
https://www.ncbi.nlm.nih.gov/pubmed/34024911
http://dx.doi.org/10.1016/j.cplett.2021.138745

Ejemplares similares