{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,11,11]],"date-time":"2025-11-11T12:54:29Z","timestamp":1762865669079},"reference-count":29,"publisher":"American Chemical Society (ACS)","issue":"6","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2010,6,28]]},"DOI":"10.1021\/ci100090p","type":"journal-article","created":{"date-parts":[[2010,5,26]],"date-time":"2010-05-26T19:03:34Z","timestamp":1274900614000},"page":"1012-1020","source":"Crossref","is-referenced-by-count":62,"title":["Ligand-Based Virtual Screening Using Bayesian Networks"],"prefix":"10.1021","volume":"50","author":[{"given":"Ammar","family":"Abdo","sequence":"first","affiliation":[{"name":"Faculty of Computer Science and Information Systems, Universiti Teknologi Malaysia, 81310, Skudai, Malaysia, Krebs Institute for Biomolecular Research, and Departments of Chemistry, Information Studies, University of Sheffield, Sheffield S10 2TN, U.K."}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Beining","family":"Chen","sequence":"additional","affiliation":[{"name":"Faculty of Computer Science and Information Systems, Universiti Teknologi Malaysia, 81310, Skudai, Malaysia, Krebs Institute for Biomolecular Research, and Departments of Chemistry, Information Studies, University of Sheffield, Sheffield S10 2TN, U.K."}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Christoph","family":"Mueller","sequence":"additional","affiliation":[{"name":"Faculty of Computer Science and Information Systems, Universiti Teknologi Malaysia, 81310, Skudai, Malaysia, Krebs Institute for Biomolecular Research, and Departments of Chemistry, Information Studies, University of Sheffield, Sheffield S10 2TN, U.K."}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Naomie","family":"Salim","sequence":"additional","affiliation":[{"name":"Faculty of Computer Science and Information Systems, Universiti Teknologi Malaysia, 81310, Skudai, Malaysia, Krebs Institute for Biomolecular Research, and Departments of Chemistry, Information Studies, University of Sheffield, Sheffield S10 2TN, U.K."}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Peter","family":"Willett","sequence":"additional","affiliation":[{"name":"Faculty of Computer Science and Information Systems, Universiti Teknologi Malaysia, 81310, Skudai, Malaysia, Krebs Institute for Biomolecular Research, and Departments of Chemistry, Information Studies, University of Sheffield, Sheffield S10 2TN, U.K."}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2010,5,26]]},"reference":[{"key":"ref1\/cit1","volume-title":"An Introduction to Chemoinformatics","author":"Leach A. R.","year":"2003"},{"key":"ref2\/cit2","doi-asserted-by":"crossref","first-page":"5851","DOI":"10.1021\/jm060999m","volume":"49","author":"Leach A. R.","year":"2006","journal-title":"J. Med. Chem."},{"key":"ref3\/cit3","doi-asserted-by":"crossref","first-page":"27","DOI":"10.1016\/S1359-6446(04)02939-3","volume":"9","author":"Lengauer T.","year":"2004","journal-title":"Drug Discovery Today"},{"key":"ref4\/cit4","doi-asserted-by":"crossref","first-page":"903","DOI":"10.1016\/S1359-6446(02)02411-X","volume":"7","author":"Sheridan R. P.","year":"2002","journal-title":"Drug Discovery Today"},{"key":"ref5\/cit5","volume-title":"Concepts and Application of Molecular Similarity","author":"Johnson M. A.","year":"1990"},{"key":"ref6\/cit6","doi-asserted-by":"crossref","first-page":"983","DOI":"10.1021\/ci9800211","volume":"38","author":"Willett P.","year":"1998","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ref7\/cit7","doi-asserted-by":"crossref","first-page":"1006","DOI":"10.1002\/qsar.200330831","volume":"22","author":"Nikolova N.","year":"2003","journal-title":"QSAR Comb. Sci."},{"key":"ref8\/cit8","doi-asserted-by":"crossref","first-page":"3204","DOI":"10.1039\/b409813g","volume":"2","author":"Bender A.","year":"2004","journal-title":"Org. Biomol. Chem."},{"key":"ref9\/cit9","doi-asserted-by":"crossref","first-page":"39","DOI":"10.1007\/s11030-006-8697-1","volume":"10","author":"Maldonado A.","year":"2006","journal-title":"Mol. Diversity"},{"key":"ref10\/cit10","doi-asserted-by":"crossref","unstructured":"Turtle, H.; Croft, W. B.InInference Networks for Document Retrieval, Proceedings of the 13th Annual International ACM SIGIR Conference on Research and Development in Information Retrieval, Brussels, Belgium, 1990;Association for Computing Machinery:New York, 1990; pp1\u221224.","DOI":"10.1145\/96749.98006"},{"key":"ref11\/cit11","doi-asserted-by":"crossref","unstructured":"Ribeiro, B.; Muntz, R.InA Belief Network Model for IR, Proceedings of the 19th Annual International ACM SIGIR Conference on Research and Development in Information Retrieval, Zurich, Switzerland, 1996;Association for Computing Machinery:New York, 1996; pp253\u2212260.","DOI":"10.1145\/243199.243272"},{"key":"ref12\/cit12","doi-asserted-by":"crossref","first-page":"265","DOI":"10.1016\/j.ijar.2003.07.011","volume":"34","author":"de Campos L. M.","year":"2003","journal-title":"Int. J. Approximate Reasoning"},{"key":"ref13\/cit13","volume":"5","author":"Willett P.","year":"2000","journal-title":"Inf. Research"},{"key":"ref14\/cit14","doi-asserted-by":"crossref","unstructured":"Abdo, A.; Salim, N.InInference Networks for Chemical Similarity Searching, Proceeding of the International Conference on Advanced Computer Theory and Engineering, Phuket, Thailand, 20\u221222 December, 2008;IEEE Computer Society:Los Alamitos, CA, 2008; pp408\u2212412.","DOI":"10.1109\/ICACTE.2008.113"},{"key":"ref15\/cit15","doi-asserted-by":"crossref","first-page":"210","DOI":"10.1002\/cmdc.200800290","volume":"4","author":"Abdo A.","year":"2009","journal-title":"ChemMedChem."},{"key":"ref16\/cit16","volume-title":"Molecular Similarity Searching Using Inference Network","author":"Abdo A.","year":"2009"},{"key":"ref17\/cit17","unstructured":"Symyx Technologies. MDL Drug Data Report.http:\/\/www.symyx.com\/products\/databases\/bioactivity\/mddr\/index.jsp(accessed April 20, 2010)."},{"key":"ref18\/cit18","doi-asserted-by":"publisher","DOI":"10.1186\/1758-2946-1-5"},{"key":"ref19\/cit19","unstructured":"Sunset Molecular Discovery. World of Molecular Bioactivity.http:\/\/www.sunsetmolecular.com\/(accessed April 20, 2010)."},{"key":"ref20\/cit20","doi-asserted-by":"crossref","first-page":"187","DOI":"10.1145\/125187.125188","volume":"9","author":"Turtle H.","year":"1991","journal-title":"ACM Trans. Inf. Syst."},{"key":"ref21\/cit21","doi-asserted-by":"crossref","first-page":"367","DOI":"10.1145\/326440.326444","volume":"17","author":"Greiff W. R.","year":"1999","journal-title":"ACM Trans. Inf. Syst."},{"key":"ref22\/cit22","doi-asserted-by":"crossref","first-page":"654","DOI":"10.1002\/qsar.200860155","volume":"28","author":"Abdo A.","year":"2009","journal-title":"QSAR Comb. Sci."},{"key":"ref23\/cit23","doi-asserted-by":"crossref","first-page":"655","DOI":"10.1007\/s10822-009-9285-0","volume":"23","author":"Arif S.","year":"2009","journal-title":"J. Comput.-Aided Mol. Des."},{"key":"ref24\/cit24","unstructured":"Pipeline Pilot;Accelrys Software Inc.:San Diego, CA, 2008."},{"key":"ref25\/cit25","doi-asserted-by":"crossref","first-page":"462","DOI":"10.1021\/ci050348j","volume":"46","author":"Hert J.","year":"2006","journal-title":"J. Chem. Inf. Model."},{"key":"ref26\/cit26","doi-asserted-by":"crossref","first-page":"103","DOI":"10.1002\/sam.10037","volume":"2","author":"Gardiner E. J.","year":"2009","journal-title":"Stat. Anal. Data Mining."},{"key":"ref27\/cit27","doi-asserted-by":"crossref","first-page":"169","DOI":"10.1021\/ci8002649","volume":"49","author":"Rohrer S. G.","year":"2009","journal-title":"J. Chem. Inf. Model."},{"key":"ref28\/cit28","volume-title":"Nonparametric Statistics for The Behavioral Sciences","author":"Siegel S.","year":"1988"},{"key":"ref29\/cit29","doi-asserted-by":"crossref","first-page":"423","DOI":"10.1517\/17460441.2.4.423","volume":"2","author":"Sheridan R. P.","year":"2007","journal-title":"Expert Opin. Drug Discovery"}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci100090p","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2023,3,23]],"date-time":"2023-03-23T14:23:14Z","timestamp":1679581394000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci100090p"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2010,5,26]]},"references-count":29,"journal-issue":{"issue":"6","published-print":{"date-parts":[[2010,6,28]]}},"alternative-id":["10.1021\/ci100090p"],"URL":"https:\/\/doi.org\/10.1021\/ci100090p","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2010,5,26]]}}}