Strategy of Structure Generation within Applicability Domains with One-Class Support Vector Machine
Author:
Affiliation:
1. Department of Chemical System Engineering, School of Engineering, The University of Tokyo
Publisher
The Chemical Society of Japan
Subject
General Chemistry
Link
http://www.journal.csj.jp/doi/pdf/10.1246/bcsj.20150054
Reference41 articles.
1. Inverse problem in QSAR/QSPR studies for the case of topological indexes characterizing molecular shape (Kier indices)
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