Characterization of Amino Acid Based Molecular Micelles with Molecular Modeling.

ABSTRACT: The enantiomers of chiral drugs often have different potencies, toxicities, and biochemical properties. Therefore, the FDA and other worldwide regulatory agencies require manufactures to test and prove the enantiomeric purity of chiral drugs. Amino acid based molecular micelles (AABMM) have been used in chiral CE separations since the 1990's because of their low environmental impact and because their properties can easily be tuned by changing the amino acids in the chiral surfactant headgroups. Using molecular dynamics simulations to investigate the structures and properties of AABMM is part of an ongoing study focusing on investigating and elucidating the factors responsible for chiral recognition with AABMM. The results will be useful for the proper design and selection of more efficient

SUBMITTER: Billiot A 

PROVIDER: S-EPMC8130901 | biostudies-literature | 2019 Nov

REPOSITORIES: biostudies-literature