Journal
QUIMICA NOVA
Volume 24, Issue 5, Pages 658-671Publisher
SOC BRASILEIRA QUIMICA
DOI: 10.1590/S0100-40422001000500013
Keywords
quantitative structure-activity relationships; multiple linear regression; validation of QSAR models
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The present paper aims to bring under discussion some theoretical and practical aspects about the proposition, validation and analysis of QSAR models based on multiple linear regression. A comprehensive approach for the derivation of extrathermodynamic equations is reviewed. Some examples of QSAR models published in the literature are analyzed and criticized.
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