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Chemical Fragment Spaces for de novo Design., and . Journal of Chemical Information and Modeling, 47 (2): 318-324 (2007)Mechanistic insights into oxidosqualene cyclizations through homology modeling., and . J. Comput. Chem., 24 (6): 741-753 (2003)Prediction of pKa shifts in proteins using a combination of molecular mechanical and continuum solvent calculations., , and . J. Comput. Chem., 25 (15): 1865-1872 (2004)Recore: A Fast and Versatile Method for Scaffold Hopping Based on Small Molecule Crystal Structure Conformations., , , and . Journal of Chemical Information and Modeling, 47 (2): 390-399 (2007)Database Clustering with a Combination of Fingerprint and Maximum Common Substructure Methods., and . Journal of Chemical Information and Modeling, 45 (3): 542-548 (2005)Ensemble Methods for Classification in Cheminformatics., , , , , and . J. Chem. Inf. Model., 44 (6): 1971-1978 (2004)Prediction of UV and ESI-MS Signal Intensities., , , and . J. Chem. Inf. Model., 45 (4): 1039-1046 (2005)Similarity searching in large combinatorial chemistry spaces., and . J. Comput. Aided Mol. Des., 15 (6): 497-520 (2001)A Medicinal Chemist’s Guide to Molecular Interactions, , and . Journal of Medicinal Chemistry, 53 (14): 5061-5084 (2010)PMID: 20345171.Equalized contrast display processing for digital radiography., , , and . Medical Imaging: Image-Guided Procedures, volume 4681 of SPIE Proceedings, SPIE, (2002)