Similarity-Based Classifier Using Topomers to Provide a Knowledge Base for hERG Channel Inhibition. - Britta Nisius; Andreas H. Göller (J. Chem. Inf. Model., 2009)

Fragment Shuffling: An Automated Workflow for Three-Dimensional Fragment-Based Ligand Design. - Britta Nisius; Ulrich Rester (J. Chem. Inf. Model., 2009)

Development of a Fingerprint Reduction Approach for Bayesian Similarity Searching Based on Kullback-Leibler Divergence Analysis. - Britta Nisius; Martin Vogt 001; Jürgen Bajorath (J. Chem. Inf. Model., 2009)

Predicting the similarity search performance of fingerprints and their combination with molecular property descriptors using probabilistic and information theoretic modeling. - Martin Vogt 001; Britta Nisius; Jürgen Bajorath (Stat. Anal. Data Min., 2009)

Identification of Descriptors Capturing Compound Class-Specific Features by Mutual Information Analysis. - Anne Mai Wassermann; Britta Nisius; Martin Vogt 001; Jürgen Bajorath (J. Chem. Inf. Model., 2010)

Rationalizing the Role of SAR Tolerance for Ligand-Based Virtual Screening. - Peter Ripphausen; Britta Nisius; Mathias Wawer; Jürgen Bajorath (J. Chem. Inf. Model., 2011)

Correction to Identification of Descriptors Capturing Compound Class-Specific Features by Mutual Information Analysis. - Anne Mai Wassermann; Britta Nisius; Martin Vogt 001; Jürgen Bajorath (J. Chem. Inf. Model., 2011)

Novel binding pocket descriptors based on DrugScore potential fields encoded by 3D Zernike descriptors. - Britta Nisius; Sha Fan; Holger Gohlke (J. Cheminformatics, 2012)

Alignment-Independent Comparison of Binding Sites Based on DrugScore Potential Fields Encoded by 3D Zernike Descriptors. - Britta Nisius; Holger Gohlke (J. Chem. Inf. Model., 2012)