SAHN Clustering in Arbitrary Metric Spaces Using Heuristic Nearest Neighbor Search. - Nils M. Kriege; Petra Mutzel; Till Schäfer (WALCOM, 2014)

Scaffold hunter: visual analysis of biological activity data. - Karsten Klein 001; Oliver Koch; Nils M. Kriege; Petra Mutzel; Till Schäfer (J. Cheminformatics, 2014)

Practical SAHN Clustering for Very Large Data Sets and Expensive Distance Metrics. - Nils M. Kriege; Petra Mutzel; Till Schäfer (J. Graph Algorithms Appl., 2014)

Extending the Scaffold Hunter Visualization Toolkit with Interactive Heatmaps. - Werner Sturm; Till Schäfer; Tobias Schreck; Andreas Holzinger; Torsten Ullrich (CGVC, 2015)

StruClus: Structural Clustering of Large-Scale Graph Databases. - Till Schäfer; Petra Mutzel (CoRR, 2016)

StruClus: Scalable Structural Graph Set Clustering with Representative Sampling. - Till Schäfer; Petra Mutzel (ADMA, 2017)

Scaffold Hunter: a comprehensive visual analytics framework for drug discovery. - Till Schäfer; Nils M. Kriege; Lina Humbeck; Karsten Klein 001; Oliver Koch; Petra Mutzel (J. Cheminformatics, 2017)

Protein Complex Similarity Based on Weisfeiler-Lehman Labeling. - Bianca K. Stöcker; Till Schäfer; Petra Mutzel; Johannes Köster; Nils M. Kriege; Sven Rahmann (SISAP, 2019)

Protein Complex Similarity. - Bianca K. Stöcker; Till Schäfer; Petra Mutzel; Johannes Köster; Nils M. Kriege; Sven Rahmann (Mach. Learn. under Resour. Constraints Vol. 3 (3), 2022)

Graph-Based Methods for Rational Drug Design. - Andre Droschinsky; Lina Humbeck; Oliver Koch; Nils M. Kriege; Petra Mutzel; Till Schäfer (Algorithms for Big Data, 2022)

Graph set data mining: clustering and pattern mining in the context of cheminformatics. - Till Schäfer (2023)