Virtual screening by high-throughput docking using hydrogen bonding constraints for targeting a protein-protein interface in M. tuberculosis. - Oliver Koch; Timo Jäger; Leopold Flohé; Paul M. Selzer (J. Cheminformatics, 2010)

Virtual screening using structure-based consensus pharmacophore models and ensemble docking based on MD-generated conformations. - Oliver Koch; Daniel Cappel; Monika Nocker; Timo Jäger; Leopold Flohé; Christoph A. Sotriffer; Paul M. Selzer (J. Cheminformatics, 2011)