{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,2,21]],"date-time":"2026-02-21T10:33:43Z","timestamp":1771670023641,"version":"3.50.1"},"reference-count":18,"publisher":"Springer Science and Business Media LLC","issue":"12","license":[{"start":{"date-parts":[[2004,12,1]],"date-time":"2004-12-01T00:00:00Z","timestamp":1101859200000},"content-version":"tdm","delay-in-days":0,"URL":"http:\/\/www.springer.com\/tdm"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J Comput Aided Mol Des"],"published-print":{"date-parts":[[2004,12]]},"DOI":"10.1007\/s10822-004-6986-2","type":"journal-article","created":{"date-parts":[[2005,6,28]],"date-time":"2005-06-28T00:06:51Z","timestamp":1119917211000},"page":"761-771","source":"Crossref","is-referenced-by-count":32,"title":["The de novo design of median molecules within a property range of interest"],"prefix":"10.1007","volume":"18","author":[{"given":"Nathan","family":"Brown","sequence":"first","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Ben","family":"McKay","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Johann","family":"Gasteiger","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"297","published-online":{"date-parts":[[2005,6,27]]},"reference":[{"key":"6986_CR1","doi-asserted-by":"crossref","first-page":"64","DOI":"10.1021\/ci00046a002","volume":"25","author":"R.E. Carhart","year":"1985","journal-title":"J. Chem Inf. Comput. Sci.,"},{"key":"6986_CR2","doi-asserted-by":"crossref","first-page":"36","DOI":"10.1021\/ci00049a008","volume":"26","author":"P. Willett","year":"1986","journal-title":"J. Chem Inf. Comput. Sci.,"},{"key":"6986_CR3","doi-asserted-by":"crossref","first-page":"983","DOI":"10.1021\/ci9800211","volume":"38","author":"P. Willett","year":"1998","journal-title":"J. Chem Inf. Comput. Sci.,"},{"key":"6986_CR4","doi-asserted-by":"crossref","first-page":"1079","DOI":"10.1021\/ci034290p","volume":"44","author":"N. Brown","year":"2004","journal-title":"J. Chem Inf. Comput. Sci.,"},{"key":"6986_CR5","first-page":"5","volume-title":"The 15th European Symposium on Quantitative Structure\u2013Activity Relationships","author":"N. Brown","year":"(September 2004)."},{"key":"6986_CR6","first-page":"416","volume-title":"Genetic Algorithms: Proceedings of the Fifth International Conference","author":"C.M. Fonseca","year":"1993"},{"key":"6986_CR7","doi-asserted-by":"crossref","first-page":"220","DOI":"10.1021\/ci970438r","volume":"38","author":"S. Handschuh","year":"1998","journal-title":"J. Chem Inf. Comput. Sci.,"},{"key":"6986_CR8","doi-asserted-by":"crossref","first-page":"57","DOI":"10.1023\/A:1010072431120","volume":"1","author":"R.B. Nachbar","year":"2000","journal-title":"Genet Program. Evolvable Mach.,"},{"key":"6986_CR9","volume-title":"Concepts and Applications of Molecular Similarity","author":"M.A. Johnson","year":"1990"},{"key":"6986_CR10","unstructured":"The SIMCA-P 10.5 software is available from Umetrics at http:\/\/www.umetrics.com\/."},{"key":"6986_CR11","doi-asserted-by":"crossref","first-page":"8533","DOI":"10.1021\/ja00179a044","volume":"112","author":"K.J. Miller","year":"1990","journal-title":"J. Chem. Chem. Soc.,"},{"key":"6986_CR12","unstructured":"The PETRA software is available from Molecular Networks, GmbH at http:\/\/www.mol-net.com."},{"key":"6986_CR13","unstructured":"The Dragon 4 software is available from Talete, Srl at http:\/\/www.talete.mi.it\/."},{"key":"6986_CR14","doi-asserted-by":"crossref","first-page":"450","DOI":"10.1021\/ci970100x","volume":"38","author":"J. Huuskonen","year":"1998","journal-title":"J. Chem Inf. Comput. Sci.,"},{"key":"6986_CR15","doi-asserted-by":"crossref","first-page":"821","DOI":"10.1002\/qsar.200330822","volume":"22","author":"A. Yan","year":"2003","journal-title":"QSAR Comb Sci.,"},{"key":"6986_CR16","doi-asserted-by":"crossref","first-page":"225","DOI":"10.1023\/A:1027221424359","volume":"11","author":"H. Kubinyi","year":"1998","journal-title":"Perspect Drug. Discov. Des."},{"key":"6986_CR17","doi-asserted-by":"crossref","first-page":"4350","DOI":"10.1021\/jm020155c","volume":"45","author":"Y.C. Martin","year":"2002","journal-title":"J. Med Chem."},{"key":"6986_CR18","doi-asserted-by":"crossref","first-page":"295","DOI":"10.2174\/1386207013331129","volume":"4","author":"J.V. Juli\u00e1n-Ortiz de","year":"2001","journal-title":"Comb Chem. High Throughput Screen."}],"container-title":["Journal of Computer-Aided Molecular Design"],"original-title":[],"language":"en","link":[{"URL":"http:\/\/link.springer.com\/content\/pdf\/10.1007\/s10822-004-6986-2.pdf","content-type":"application\/pdf","content-version":"vor","intended-application":"text-mining"},{"URL":"http:\/\/link.springer.com\/article\/10.1007\/s10822-004-6986-2\/fulltext.html","content-type":"text\/html","content-version":"vor","intended-application":"text-mining"},{"URL":"http:\/\/link.springer.com\/content\/pdf\/10.1007\/s10822-004-6986-2","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2019,5,30]],"date-time":"2019-05-30T21:22:51Z","timestamp":1559251371000},"score":1,"resource":{"primary":{"URL":"http:\/\/link.springer.com\/10.1007\/s10822-004-6986-2"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2004,12]]},"references-count":18,"journal-issue":{"issue":"12","published-print":{"date-parts":[[2004,12]]}},"alternative-id":["6986"],"URL":"https:\/\/doi.org\/10.1007\/s10822-004-6986-2","relation":{},"ISSN":["0920-654X","1573-4951"],"issn-type":[{"value":"0920-654X","type":"print"},{"value":"1573-4951","type":"electronic"}],"subject":[],"published":{"date-parts":[[2004,12]]}}}