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Methods |
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| Quantitative structure-activity relationship, QSAR, is a concept usually put to exercise when designing drugs.
The QSAR method relates properties obtained from the structure of different molecules with a biological activity
that is of interest.
The properties can often be expressed as chemical descriptors and these can be modelled to the activity
with PLS. It is also possible to discriminate between classes of molecules using PLS-DA. Evince provides functionality for calculating chemical descriptors for molecules as well as analysing them. |
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 A modern software for multivariate data analysis & chemometrics  |
 A complete system for keeping track of your chemical storage |
 Multivariate data analysis consulting within biotechnology and chemistry |
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