Discovery of cell-permeable non-peptide inhibitors of beta-secretase by high-throughput docking and continuum electrostatics calculations.
Huang D, Luthi U, Kolb P, Edler K, Cecchini M, Audetat S, Barberis A, Caflisch A, J Med Chem, 2005 Aug 11 - link

Automated docking of highly flexible ligands by genetic algorithms: a critical assessment.
Cecchini M, Kolb P, Majeux N, Caflisch A, J Comput Chem, 2004 Feb - link