How to Simulate Affinities for Host-Guest Systems Lacking Binding Mode Information: application to the liquid chromatographic separation of hexabromocyclododecane stereoisomers
Author: | Vedat Durmaz, Marcus Weber, Roland Becker |
---|---|
Document Type: | Article |
Parent Title (English): | Journal of Molecular Modeling |
Volume: | 18 |
First Page: | 2399 |
Last Page: | 2408 |
Year of first publication: | 2012 |
DOI: | https://doi.org/10.1007/s00894-011-1239-5 |