Drug Resistance Mechanism of M46I-Mutation-Induced Saquinavir Resistance in HIV-1 Protease Using Molecular Dynamics Simulation and Binding Energy Calculation

Drug-resistance-associated mutation in essential proteins of the viral life cycle is a major concern in anti-retroviral therapy. M46I, a non-active site mutation in HIV-1 protease has been clinically associated with saquinavir resistance in HIV patients. A 100 ns molecular dynamics (MD) simulation a...

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Detalles Bibliográficos
Autores principales: Rana, Nilottam, Singh, Atul Kumar, Shuaib, Mohd, Gupta, Sanjay, Habiballah, Mahmoud M., Alkhanani, Mustfa F., Haque, Shafiul, Reshi, Mohd Salim, Kumar, Shashank
Formato: Online Artículo Texto
Lenguaje:English
Publicado: MDPI 2022
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9031992/
https://www.ncbi.nlm.nih.gov/pubmed/35458427
http://dx.doi.org/10.3390/v14040697

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