Article ID Journal Published Year Pages File Type
1179522 Chemometrics and Intelligent Laboratory Systems 2015 28 Pages PDF
Abstract

One of the most extended subfields of chemometrics, at least by considering the number of publications and interested researchers, is QSAR/QSPR. During the time, various improved and/or alternative methods have been developed in different principal steps of QSAR/QSPR including (i) variable selection, (ii) model construction and (iii) validation evaluation. In the current manuscript, it is tried to represent a short overview on critical and bold developments of chemometrics tools utilized in QSAR/QSPR studies.

Related Topics
Physical Sciences and Engineering Chemistry Analytical Chemistry
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