Interpreting linear support vector machine models with heat map molecule coloring

<p>Abstract</p> <p>Background</p> <p>Model-based virtual screening plays an important role in the early drug discovery stage. The outcomes of high-throughput screenings are a valuable source for machine learning algorithms to infer such models. Besides a strong performa...

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Bibliographic Details
Main Authors: Rosenbaum Lars, Hinselmann Georg, Jahn Andreas, Zell Andreas
Format: Article
Language:English
Published: BMC 2011-03-01
Series:Journal of Cheminformatics
Online Access:http://www.jcheminf.com/content/3/1/11