Evaluation of the performance of 3D virtual screening protocols: RMSD comparisons, enrichment assessments, and decoy selection - What can we learn from earlier mistakes? - Johannes Kirchmair; Patrick Markt; Simona Distinto; Gerhard Wolber; Thierry Langer (J. Comput. Aided Mol. Des., 2008)

Discovery of Novel Cathepsin S Inhibitors by Pharmacophore-Based Virtual High-Throughput Screening. - Patrick Markt; Caroline McGoohan; Brian Walker; Johannes Kirchmair; Clemens Feldmann; Gabriella De Martino; Gudrun M. Spitzer; Simona Distinto; Daniela Schuster 001; Gerhard Wolber; Christian Laggner; Thierry Langer (J. Chem. Inf. Model., 2008)

How To Optimize Shape-Based Virtual Screening: Choosing the Right Query and Including Chemical Information. - Johannes Kirchmair; Simona Distinto; Patrick Markt; Daniela Schuster 001; Gudrun M. Spitzer; Klaus R. Liedl; Gerhard Wolber (J. Chem. Inf. Model., 2009)

Critical Comparison of Virtual Screening Methods against the MUV Data Set. - Pekka Tiikkainen; Patrick Markt; Gerhard Wolber; Johannes Kirchmair; Simona Distinto; Antti Poso; Olli-P. Kallioniemi (J. Chem. Inf. Model., 2009)

GRID-Based Three-Dimensional Pharmacophores II: PharmBench, a Benchmark Data Set for Evaluating Pharmacophore Elucidation Methods. - Simon Cross; Francesco Ortuso; Massimo Baroni; Giosuè Costa; Simona Distinto; Federica Moraca; Stefano Alcaro; Gabriele Cruciani (J. Chem. Inf. Model., 2012)