{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,12]],"date-time":"2025-10-12T19:24:59Z","timestamp":1760297099366},"reference-count":28,"publisher":"American Chemical Society (ACS)","issue":"2","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Comput. Sci."],"published-print":{"date-parts":[[2004,3,1]]},"DOI":"10.1021\/ci034170h","type":"journal-article","created":{"date-parts":[[2004,3,22]],"date-time":"2004-03-22T13:14:31Z","timestamp":1079961271000},"page":"716-726","source":"Crossref","is-referenced-by-count":30,"title":["Classification and Regression TreesStudies of HIV Reverse Transcriptase Inhibitors"],"prefix":"10.1021","volume":"44","author":[{"given":"M.","family":"Daszykowski","sequence":"first","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"B.","family":"Walczak","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Q.-S.","family":"Xu","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"F.","family":"Daeyaert","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"M. R.","family":"de Jonge","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"J.","family":"Heeres","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"L. M. H.","family":"Koymans","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"P. J.","family":"Lewi","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"H. M.","family":"Vinkers","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"P. A.","family":"Janssen","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"D. L.","family":"Massart","sequence":"additional","affiliation":[{"name":"FABI, ChemoAC, Vrije Universiteit Brussels, Laarbeeklaan 103, B-1090 Brussels, Belgium, and Center for Molecular Design, Janssen Pharmaceutica N.V., Antwerpsesteenweg 37, B-2350, Vosselaar, Belgium"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2004,1,13]]},"reference":[{"key":"ci034170hb00001\/ci034170hb00001_1","doi-asserted-by":"crossref","first-page":"276","DOI":"10.1128\/AAC.42.2.269","volume":"42","author":"Hertogs K.","year":"1998","journal-title":"Antimicrob. Agents Chemother."},{"key":"ci034170hb00002\/ci034170hb00002_1","volume-title":"Molecular Modelling, Principles and Applications","author":"Leach A. R.","year":"1996"},{"key":"ci034170hb00003\/ci034170hb00003_1","doi-asserted-by":"crossref","first-page":"445","DOI":"10.1006\/jmbi.2001.4648","volume":"309","author":"Hsiou Y.","year":"2001","journal-title":"J. Mol. Biol."},{"key":"ci034170hb00004\/ci034170hb00004_1","volume-title":"Classification and Regression Trees","author":"Breiman L.","year":"1984"},{"key":"ci034170hb00005\/ci034170hb00005_1","doi-asserted-by":"crossref","first-page":"72","DOI":"10.1080\/02772240109358976","volume":"79","author":"Simeonov V.","year":"2001","journal-title":"Toxicol. Environ. Chem."},{"key":"ci034170hb00006\/ci034170hb00006_1","doi-asserted-by":"crossref","first-page":"2830","DOI":"10.1016\/S1352-2310(02)00155-3","volume":"36","author":"Kuebler J.","year":"2002","journal-title":"Atmos. Environ."},{"key":"ci034170hb00007\/ci034170hb00007_1","doi-asserted-by":"crossref","first-page":"609","DOI":"10.1016\/S0895-4356(00)00344-9","volume":"54","author":"Marshall R. J","year":"2001","journal-title":"J. Clin. Epidemiol."},{"key":"ci034170hb00008\/ci034170hb00008_1","doi-asserted-by":"crossref","first-page":"122","DOI":"10.1016\/S0167-9473(02)00061-0","volume":"41","author":"Fodor I. K.","year":"2002","journal-title":"Comput. Stat. Data Anal."},{"key":"ci034170hb00009\/ci034170hb00009_1","first-page":"276","volume":"998","author":"Put R.","year":"2003","journal-title":"J. Chromatogr. A"},{"key":"ci034170hb00010\/ci034170hb00010_1","doi-asserted-by":"crossref","first-page":"3192","DOI":"10.1890\/0012-9658(2000)081[3178:CARTAP]2.0.CO;2","volume":"81","author":"De'Ath G.","year":"2000","journal-title":"Ecology"},{"key":"ci034170hb00011\/ci034170hb00011_1","first-page":"354","volume":"13","author":"Chou P. A","year":"1991","journal-title":"IEEE Trans. Pattern Anal. Machine Learning"},{"key":"ci034170hb00012\/ci034170hb00012_1","doi-asserted-by":"crossref","first-page":"701","DOI":"10.1016\/S0167-9473(02)00171-8","volume":"42","author":"Bose S","year":"2003","journal-title":"Comput. Stat. Data Anal."},{"key":"ci034170hb00013\/ci034170hb00013_1","volume-title":"Proceedings of the First International Conference on Knowledge Discovery and Data Mining (KDD '95)","author":"Mehta M."},{"key":"ci034170hb00014\/ci034170hb00014_1","doi-asserted-by":"crossref","first-page":"299","DOI":"10.1016\/S0167-9473(01)00044-5","volume":"38","author":"Cappelli C.","year":"2002","journal-title":"Comput. Stat. Data Anal."},{"key":"ci034170hb00015\/ci034170hb00015_1","volume-title":"PROTEINS","author":"Daeyaert F.","year":"2003"},{"key":"ci034170hb00016\/ci034170hb00016_1","author":"Lewi P. J.","journal-title":"J. Comput.-Aided Mol. Design, in press."},{"key":"ci034170hb00017\/ci034170hb00017_1","first-page":"519","volume":"17","author":"Halgren T. A","year":"1996","journal-title":"J. Comput. Chem."},{"key":"ci034170hb00018\/ci034170hb00018_1","doi-asserted-by":"crossref","first-page":"276","DOI":"10.1128\/AAC.42.2.269","volume":"42","author":"Hertogs K.","year":"1998","journal-title":"Antimicrob. Agents Chemother."},{"key":"ci034170hb00019\/ci034170hb00019_1","doi-asserted-by":"crossref","first-page":"2773","DOI":"10.1021\/jm030809x","volume":"46","author":"Vinkers H. M.","year":"2003","journal-title":"J. Med. Chem."},{"key":"ci034170hb00020\/ci034170hb00020_1","doi-asserted-by":"crossref","first-page":"323","DOI":"10.1006\/jmbi.1998.2171","volume":"284","author":"Hsiou Y.","year":"1998","journal-title":"J. Mol. Biol."},{"key":"ci034170hb00021\/ci034170hb00021_1","doi-asserted-by":"crossref","first-page":"4505","DOI":"10.1021\/jm990192c","volume":"42","author":"Hopkins A. L.","year":"1999","journal-title":"J. Med. Chem."},{"key":"ci034170hb00022\/ci034170hb00022_1","first-page":"5639","volume":"275","author":"Ren J.","year":"2000","journal-title":"J. Biol. Chem."},{"key":"ci034170hb00023\/ci034170hb00023_1","first-page":"1094","volume":"8","author":"Ren J.","year":"2000","journal-title":"Structure"},{"key":"ci034170hb00024\/ci034170hb00024_1","first-page":"415","volume":"2","author":"Ding J.","year":"1995","journal-title":"Nat. Struct. Biol."},{"key":"ci034170hb00025\/ci034170hb00025_1","first-page":"926","volume":"3","author":"Ren J.","year":"1995","journal-title":"Structure"},{"key":"ci034170hb00026\/ci034170hb00026_1","doi-asserted-by":"crossref","first-page":"1600","DOI":"10.1021\/jm960056x","volume":"39","author":"Hopkins A. L.","year":"1996","journal-title":"J. Med. Chem."},{"key":"ci034170hb00027\/ci034170hb00027_1","first-page":"14403","volume":"37","author":"Ren J.","year":"1998","journal-title":"Biochemistry"},{"key":"ci034170hb00028\/ci034170hb00028_1","first-page":"302","volume":"2","author":"Ren J.","year":"1995","journal-title":"Nature Struct. Biol."}],"container-title":["Journal of Chemical Information and Computer Sciences"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci034170h","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2021,10,3]],"date-time":"2021-10-03T07:14:29Z","timestamp":1633245269000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci034170h"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2004,1,13]]},"references-count":28,"journal-issue":{"issue":"2","published-print":{"date-parts":[[2004,3,1]]}},"alternative-id":["10.1021\/ci034170h"],"URL":"https:\/\/doi.org\/10.1021\/ci034170h","relation":{},"ISSN":["0095-2338"],"issn-type":[{"value":"0095-2338","type":"print"}],"subject":[],"published":{"date-parts":[[2004,1,13]]}}}