Extended graph-based models for enhanced similarity retrieval in Cavbase. - Timo Krotzky; Thomas Fober; Marco Mernberger; Gerhard Klebe; Eyke Hüllermeier (J. Cheminformatics, 2013)

A new method for rapid comparison of protein binding pockets by capturing spatial distributions. - Timo Krotzky; Gerhard Klebe (J. Cheminformatics, 2014)

Extraction of Protein Binding Pockets in Close Neighborhood of Bound Ligands Makes Comparisons Simple Due to Inherent Shape Similarity. - Timo Krotzky; Thomas Rickmeyer; Thomas Fober; Gerhard Klebe (J. Chem. Inf. Model., 2014)

Extended Graph-Based Models for Enhanced Similarity Search in Cavbase. - Timo Krotzky; Thomas Fober; Eyke Hüllermeier; Gerhard Klebe (IEEE ACM Trans. Comput. Biol. Bioinform., 2014)

Large-Scale Mining for Similar Protein Binding Pockets: With RAPMAD Retrieval on the Fly Becomes Real. - Timo Krotzky; Christian Grunwald; Ute Egerland; Gerhard Klebe (J. Chem. Inf. Model., 2015)