In order to obtain optimal results for an asymmetric catalytic transformation in terms of enantiomeric excess and yield, understanding of the underlying kinetics is an indespensable prerequisite. Our computational tool provides a simple aid for analysis and optimization of the kinetic resolution of racemates ('Selectivity'); application for more complex processes are currently under development. For details and further references please see the corresponding help-file. Suggestions are highly welcome.

Kurt Faber
Wolfgang Kroutil
Gerhard Thallinger

This program is published without any warranty of fitness for a particular purpose. Commercial exploitation is not permitted.
© Department of Chemistry, University of Graz & Institute of Genomics and Bioinformatics, TU Graz.