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Werner Klaffke
Publication Activity (10 Years)
Years Active: 2001-2015
Publications (10 Years): 0
Top Topics
Error Correcting Output Codes
Knn
Bayes Classifier
Multiclass Learning
Top Venues
J. Chem. Inf. Model.
J. Cheminformatics
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Publications
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Lora Mak
,
David Marcus
,
Andrew Howlett
,
Galina Yarova
,
Guus Duchateau
,
Werner Klaffke
,
Andreas Bender
,
Robert C. Glen
Metrabase: a cheminformatics and bioinformatics database for small molecule transporter data analysis and (Q)SAR modeling.
J. Cheminformatics
7 (2015)
Alexios Koutsoukas
,
Robert Lowe
,
Yasaman KalantarMotamedi
,
Hamse Y. Mussa
,
Werner Klaffke
,
John B. O. Mitchell
,
Robert C. Glen
,
Andreas Bender
Erratum for "In Silico Target Predictions: Defining a Benchmarking Data Set and Comparison of Performance of the Multiclass Naı̈ve Bayes and Parzen-Rosenblatt Window".
J. Chem. Inf. Model.
54 (7) (2014)
Johannes Kirchmair
,
Andrew Howlett
,
Julio E. Peironcely
,
Daniel S. Murrell
,
Mark J. Williamson
,
Samuel E. Adams
,
Thomas Hankemeier
,
Leo van Buren
,
Guus Duchateau
,
Werner Klaffke
,
Robert C. Glen
How Do Metabolites Differ from Their Parent Molecules and How Are They Excreted?
J. Chem. Inf. Model.
53 (2) (2013)
Johannes Kirchmair
,
Andrew Howlett
,
Julio E. Peironcely
,
Daniel S. Murrell
,
Mark J. Williamson
,
Samuel E. Adams
,
Thomas Hankemeier
,
Leo van Buren
,
Guus Duchateau
,
Werner Klaffke
,
Robert C. Glen
Quantifying the shifts in physicochemical property space introduced by the metabolism of small organic molecules.
J. Cheminformatics
5 (S-1) (2013)
Alexios Koutsoukas
,
Robert Lowe
,
Yasaman KalantarMotamedi
,
Hamse Y. Mussa
,
Werner Klaffke
,
John B. O. Mitchell
,
Robert C. Glen
,
Andreas Bender
In Silico Target Predictions: Defining a Benchmarking Data Set and Comparison of Performance of the Multiclass Naïve Bayes and Parzen-Rosenblatt Window.
J. Chem. Inf. Model.
53 (8) (2013)
Martin Whittle
,
Peter Willett
,
Werner Klaffke
,
Paula van Noort
Evaluation of Similarity Measures for Searching the Dictionary of Natural Products Database.
J. Chem. Inf. Comput. Sci.
43 (2) (2003)
Shail Patel
,
Jeremy Rabone
,
Stephen Russell
,
Jos Tissen
,
Werner Klaffke
Iterated Reaction Graphs: Simulating Complex Maillard Reaction Pathways.
J. Chem. Inf. Comput. Sci.
41 (4) (2001)