Iv. Tetko et al., EVOLUTIONARY COMPUTATION FOR REVEAL STRUC TURE-ACTIVITY-RELATIONSHIPSIN 3-PHENOXYCHROMONE AND 3-PHENOXY-4-HYDROXYCOUMARIN DERIVATIVES, Bioorganiceskaa himia, 21(10), 1995, pp. 809-815
Based on a set of compounds possessing hypolipidemic activity, it was
demonstrated that evolutionary algorithms can be successfully used to
compile an informative set of molecular parameters. The parameter sets
selected using the method of potential functions allowed correct pred
iction of the activity of test molecules.