Chiral discrimination in mobile phases for HPLC
UNSPECIFIED. (2002) Chiral discrimination in mobile phases for HPLC. JOURNAL OF MOLECULAR LIQUIDS, 98-9 (Sp. Iss. SI). pp. 411-423. ISSN 0167-7322Full text not available from this repository.
In this paper we present an algorithm and some preliminary results of a computer simulation study designed to elucidate the molecular interaction mechanisms associated with chiral discrimination in chiral high performance liquid chromatography (HPLC). Molecular dynamics simulations have been performed on a novel active stationary phase constituent based on disaccharides and a model analyte in a typical solvent used as mobile phase in chiral HPLC. The results are interpreted in terms of typical binding geometries and energies found from the simulations. This paper provides basic algorithms for predicting enantiomeric selectivity and for investigating the implications for choice of parameters such as solvent polarity and temperature for optimising chiral HPLC separations.
|Item Type:||Journal Article|
|Subjects:||Q Science > QD Chemistry
Q Science > QC Physics
|Journal or Publication Title:||JOURNAL OF MOLECULAR LIQUIDS|
|Publisher:||ELSEVIER SCIENCE BV|
|Number:||Sp. Iss. SI|
|Number of Pages:||13|
|Page Range:||pp. 411-423|
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