Molecular Modeling studies on Anti-HIV and Anti-HBV Nucleosides. Design, Syntheses and Molecular Modeling studies to understand the mode of action of Anti-HIV and Anti-HBV nucleosides

      Аннотация: Design, Syntheses and Molecular Modeling studies on Anti-HIV and Anti-HBV nucleosides with special focus on understanding the underlying mechanism of their action as well as inaction. A better understanding of their mechanism will help facilitate the better designing of novel drugs to combat against them. Molecular modeling as well as Molecular Dynamics studies were conducted to ascertain their mode of binding and calculate their binding affinities and to find a correlation between their binding affinities and their biological activity.

Ключевые слова: Design, HIV, Molecular Dynamics, Syntheses, Molecular Modeling, HBV, Nucleosides, Anti viral, Adefovir, viral resistance, HBV Polymerase