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Visual Interpretation of Kernel-Based Prediction Models

Published:2011-09 Issue:9 Volume:30 Page:817-826
ISSN:1868-1743
Container-title:Molecular Informatics
language:en
Short-container-title:Mol. Inf.

Author:

Hansen Katja,Baehrens David,Schroeter Timon,Rupp Matthias,Müller Klaus-Robert

Publisher

Wiley

Subject

Organic Chemistry,Computer Science Applications,Drug Discovery,Molecular Medicine,Structural Biology

Reference28 articles.

1. Chemoinformatics in Drug Discovery

2. Applications of machine learning and computational intelligence to drug discovery and development

3. Computational Methods in Developing Quantitative Structure-Activity Relationships (QSAR): A Review

4. A Probabilistic Approach to Classifying Metabolic Stability

5. Predicting Lipophilicity of Drug-Discovery Molecules using Gaussian Process Models

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