| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 9578182 | Chemical Physics Letters | 2005 | 5 Pages |
Abstract
The zwitterionic form of aqueous l-alanine is chosen as a benchmark for the theoretical evaluation of the optical rotatory dispersion (ORD) in solution, as provided by a simple application of the perturbed matrix method (PMM). Results show the applicability of this procedure, suggesting that its use might provide a general theoretical-computational tool for describing, at atomic-molecular level, the optical activity of a molecule in a complex environment.
Related Topics
Physical Sciences and Engineering
Chemistry
Physical and Theoretical Chemistry
Authors
M. D'Abramo, M. Aschi, A. Di Nola, A. Amadei,