Molecular Dynamic Modeling in the Study of the Formation of Lipid Nanostructures
摘要
Abstract
We studied the process of self-assembly of these molecules at the atomic level. The formation of nanoparticles of phospholipid conjugates with α-, β-, and γ-cyclodextrins was modeled using the molecular dynamics method (GROMACS). Models of micelle nanoparticles were obtained, their conformation and size were determined.