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Journal of Cheminformatics
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April 26, 2014
Structure-activity relationship analysis on the basis of matched molecular pairs
Anne Mai Wassermann
Future Medicinal Chemistry
|
April 2, 2011
Large-scale exploration of bioisosteric replacements on the basis of matched molecular pairs
Anne Mai Wassermann, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
July 9, 2010
Chemical substitutions that introduce activity cliffs across different compound classes and biological targets
Anne Mai Wassermann, Jürgen Bajorath
Expert Opinion on Drug Discovery
|
June 2, 2012
BindingDB and ChEMBL: online compound databases for drug discovery
Anne Mai Wassermann, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
July 22, 2011
A data mining method to facilitate SAR transfer
Anne Mai Wassermann, Jürgen Bajorath
Journal of Medicinal Chemistry
|
January 18, 2012
Directed R-group combination graph: a methodology to uncover structure-activity relationship patterns in a series of analogues
Anne Mai Wassermann, Jürgen Bajorath
Methods in Molecular Biology (Clifton, N.J.)
|
September 15, 2010
Application of support vector machine-based ranking strategies to search for target-selective compounds
Anne Mai Wassermann, Hanna Geppert, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
September 29, 2009
Ligand prediction for orphan targets using support vector machines and various target-ligand kernels is dominated by nearest neighbor effects
Anne Mai Wassermann, Hanna Geppert, Jürgen Bajorath
Drug Discovery Today. Technologies
|
June 26, 2017
Deorphanization strategies for dark chemical matter
Anne Mai Wassermann, Matthew Tudor, Meir Glick
Journal of Chemical Information and Modeling
|
September 10, 2011
REPROVIS-DB: a benchmark system for ligand-based virtual screening derived from reproducible prospective applications
Peter Ripphausen, Anne Mai Wassermann, Jürgen Bajorath
Page
of 5
Search research articles
Search
Showing results (1-10 of 42) with videos related to
Sort By:
Page
of 5
Journal of Cheminformatics
|
April 26, 2014
Structure-activity relationship analysis on the basis of matched molecular pairs
Anne Mai Wassermann
Future Medicinal Chemistry
|
April 2, 2011
Large-scale exploration of bioisosteric replacements on the basis of matched molecular pairs
Anne Mai Wassermann, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
July 9, 2010
Chemical substitutions that introduce activity cliffs across different compound classes and biological targets
Anne Mai Wassermann, Jürgen Bajorath
Expert Opinion on Drug Discovery
|
June 2, 2012
BindingDB and ChEMBL: online compound databases for drug discovery
Anne Mai Wassermann, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
July 22, 2011
A data mining method to facilitate SAR transfer
Anne Mai Wassermann, Jürgen Bajorath
Journal of Medicinal Chemistry
|
January 18, 2012
Directed R-group combination graph: a methodology to uncover structure-activity relationship patterns in a series of analogues
Anne Mai Wassermann, Jürgen Bajorath
Methods in Molecular Biology (Clifton, N.J.)
|
September 15, 2010
Application of support vector machine-based ranking strategies to search for target-selective compounds
Anne Mai Wassermann, Hanna Geppert, Jürgen Bajorath
Journal of Chemical Information and Modeling
|
September 29, 2009
Ligand prediction for orphan targets using support vector machines and various target-ligand kernels is dominated by nearest neighbor effects
Anne Mai Wassermann, Hanna Geppert, Jürgen Bajorath
Drug Discovery Today. Technologies
|
June 26, 2017
Deorphanization strategies for dark chemical matter
Anne Mai Wassermann, Matthew Tudor, Meir Glick
Journal of Chemical Information and Modeling
|
September 10, 2011
REPROVIS-DB: a benchmark system for ligand-based virtual screening derived from reproducible prospective applications
Peter Ripphausen, Anne Mai Wassermann, Jürgen Bajorath
Page
of 5