An improved genetic algorithms and its application to QSARs of camptothecinanalogs and bistriazolols
Zhu Jie
Author information+
(Zhu J)，Zhang Wannian(Zhang WN)，Ji Haitao(Ji HT)，et a
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History+
Received
Published
1998-11-30
1999-10-05
Issue Date
1999-10-05
Abstract
OBJECTIVE:To investigate the ability of variables selection when an improved GA was used in QSAR study.METHODS:Two data sets:the camptothecin analogs with7,9,10 or 11 substituted and bistriazolols with substituted benzene ring was applied to an improved GA an alysis and PLS was used to fit models.RESULTS:Many better models were obtained than the result obtained by the standard techniques of variables selection in both data sets.CONCLUSION:GA,a heuristic searching algorithms,was suitable for QSAR because it is efficient,rapid and collateral.But it only depends on the statistic fingerposts,so some pretreatment and the checking to GA result is necessary.
Zhu Jie.
An improved genetic algorithms and its application to QSARs of camptothecinanalogs and bistriazolols[J]. Chinese Pharmaceutical Journal, 1999, 34(10): 694-697
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