Ein maximaler lokaler Algorithmus für Aufgaben der ganzzahligen linearen Optimierung. - Wolfgang Guba (J. Inf. Process. Cybern., 1975)

De novo design by pharmacophore-based searches in fragment spaces. - Tobias Lippert; Tanja Schulz-Gasch; Olivier Roche; Wolfgang Guba; Matthias Rarey (J. Comput. Aided Mol. Des., 2011)

Cross-project HTS-datamining. - Wolfgang Guba; Daniel Stoffler (J. Cheminformatics, 2011)

TFD: Torsion Fingerprints As a New Measure To Compare Small Molecule Conformations. - Tanja Schulz-Gasch; Christin Schärfer; Wolfgang Guba; Matthias Rarey (J. Chem. Inf. Model., 2012)

Torsion Library Reloaded: A New Version of Expert-Derived SMARTS Rules for Assessing Conformations of Small Molecules. - Wolfgang Guba; Agnes Meyder; Matthias Rarey; Jérôme Hert (J. Chem. Inf. Model., 2016)

The Torsion Library: Semiautomated Improvement of Torsion Rules with SMARTScompare. - Patrick Penner; Wolfgang Guba; Robert Schmidt 002; Agnes Meyder; Martin Stahl; Matthias Rarey (J. Chem. Inf. Model., 2022)