Title: Comparison of fingerprint-based methods for virtual screening using multiple bioactive reference structures Author(s): HERT, J; WILLETT, P; WILTON, DJ Source: JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES Volume: 44 Issue: 3 Pages: 1177-1185 Published: MAY-JUN 2004 Times Cited: 119 DOI: 10.1021/ci034231b
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Title: Comparison of topological descriptors for similarity-based virtual screening using multiple bioactive reference structures Author(s): HERT, J; WILLETT, P; WILTON, DJ; et al. Source: ORGANIC & BIOMOLECULAR CHEMISTRY Volume: 2 Issue: 22 Pages: 3256-3266 Published: 2004 Times Cited: 82 DOI: 10.1039/b409865j
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Title: New methods for ligand-based virtual screening: Use of data fusion and machine learning to enhance the effectiveness of similarity searching Author(s): HERT, J; WILLETT, P; WILTON, DJ; et al. Source: JOURNAL OF CHEMICAL INFORMATION AND MODELING Volume: 46 Issue: 2 Pages: 462-470 Published: MAR-APR 2006 Times Cited: 42 DOI: 10.1021/ci050348j
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Title: Enhancing the effectiveness of similarity-based virtual screening using nearest-neighbor information Author(s): HERT, J; WILLETT, P; WILTON, DJ; et al. Source: JOURNAL OF MEDICINAL CHEMISTRY Volume: 48 Issue: 22 Pages: 7049-7054 Published: NOV 3 2005 Times Cited: 16 DOI: 10.1021/jm050316n
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Title: Quantifying the relationships among drug classes Author(s): HERT, J; KEISER, MJ; IRWIN, JJ; et al. Source: JOURNAL OF CHEMICAL INFORMATION AND MODELING Volume: 48 Issue: 4 Pages: 755-765 Published: 2008 Times Cited: 9
