Probing the effect of polyethene glycol on the adsorption mechanisms of Gem on the hexagonal boron nitride as a highly efficient polymer-based drug delivery system: DFT, classical MD and Well-tempered Metadynamics simulations
Farzad, Farzaneh, Hashemzadeh, HassanVolume:
98
Journal:
Journal of Molecular Graphics and Modelling
DOI:
10.1016/j.jmgm.2020.107613
Date:
July, 2020
File:
PDF, 2.31 MB
2020