In Silico Target Predictions: Defining a Benchmarking Data Set and Comparison of Performance of the Multiclass Naïve Bayes and Parzen-Rosenblatt Window-Reference-Cited by-同舟云学术

In Silico Target Predictions: Defining a Benchmarking Data Set and Comparison of Performance of the Multiclass Naïve Bayes and Parzen-Rosenblatt Window

Published:2013-07-24 Issue:8 Volume:53 Page:1957-1966
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Koutsoukas Alexios¹,Lowe Robert¹,KalantarMotamedi Yasaman¹,Mussa Hamse Y.¹,Klaffke Werner²,Mitchell John B. O.³,Glen Robert C.¹,Bender Andreas¹

Affiliation:

1. Unilever Centre for Molecular Sciences Informatics, Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW, United Kingdom

2. Unilever R&D Vlaardingen, Olivier van Noortlaan 120, P.O. Box 114, 3130 AC Vlaardingen, The Netherlands

3. Biomedical Sciences Research Complex and EaStCHEM School of Chemistry, Purdie Building, University of St Andrews, North Haugh, St. Andrews, Scotland KY16 9ST, U.K.

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/ci300435j

Reference47 articles.

1. How were new medicines discovered?

2. Multi-parameter phenotypic profiling: using cellular effects to characterize small-molecule compounds

3. Target deconvolution strategies in drug discovery

4. Phase II failures: 2008–2010

5. Drug research: myths, hype and reality

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