Molecular modeling study to unravel complexation of daclatasvir and its enantiomer by β-cyclodextrins. Computational analysis using quantum mechanics and molecular dynamics

Autor: Peluso, Paola, Dallocchio, Roberto, Dessì, Alessandro, Salgado, Antonio, Chankvetadze, Bezhan, Scriba, Gerhard K.E.
Zdroj: In Carbohydrate Polymers 15 December 2024 346
Databáze: ScienceDirect