Confidence interval estimators for parameters associated with quantitative structure-activity relationships
- 1 November 1980
- journal article
- research article
- Published by American Chemical Society (ACS) in Journal of Medicinal Chemistry
- Vol. 23 (11) , 1201-1205
- https://doi.org/10.1021/jm00185a010
Abstract
Use of the jackknife as a statistical tool for construction of both point and confidence interval estimators for parameters which are functions of regression coefficients and/or iteratively estimated parameters is described. Examples are presented demonstrating its utility in constructing estimators for log PO and .pi.O using the parabolic and bilinear quantitative structure-activity relationship (QSAR) models relating nonlinear dependence of activity on hydrophobicity and for log [1/Ki(app) [the apparent enzyme-inhibitor dissociation constant]] assuming competitive enzyme inhibition.Keywords
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