{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,19]],"date-time":"2025-10-19T05:36:25Z","timestamp":1760852185606},"reference-count":51,"publisher":"American Chemical Society (ACS)","issue":"6","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Model."],"published-print":{"date-parts":[[2005,11,1]]},"DOI":"10.1021\/ci050263i","type":"journal-article","created":{"date-parts":[[2005,11,28]],"date-time":"2005-11-28T05:20:37Z","timestamp":1133155237000},"page":"1884-1895","source":"Crossref","is-referenced-by-count":45,"title":["Modeling of Cyclin-Dependent Kinase Inhibition by 1<i>H<\/i>-Pyrazolo[3,4-<i>d<\/i>]Pyrimidine Derivatives Using Artificial Neural Network Ensembles"],"prefix":"10.1021","volume":"45","author":[{"given":"Michael","family":"Fern\u00e1ndez","sequence":"first","affiliation":[{"name":"Molecular Modeling Group, Center for Biotechnological Studies, University of Matanzas, Matanzas, Cuba, and Scientific Prospection Group, National Centre for Scientific Researches (CNIC), P.O. Box 6880, Havana, Cuba"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Alain","family":"Tundidor-Camba","sequence":"additional","affiliation":[{"name":"Molecular Modeling Group, Center for Biotechnological Studies, University of Matanzas, Matanzas, Cuba, and Scientific Prospection Group, National Centre for Scientific Researches (CNIC), P.O. Box 6880, Havana, Cuba"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Julio","family":"Caballero","sequence":"additional","affiliation":[{"name":"Molecular Modeling Group, Center for Biotechnological Studies, University of Matanzas, Matanzas, Cuba, and Scientific Prospection Group, National Centre for Scientific Researches (CNIC), P.O. Box 6880, Havana, Cuba"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2005,10,15]]},"reference":[{"key":"ci050263ib00001\/ci050263ib00001_1","first-page":"261","volume":"27","author":"Boyle F. T.","year":"1998","journal-title":"Chem. Soc. Rev."},{"key":"ci050263ib00002\/ci050263ib00002_1","volume-title":"Cancer Chemotherapeutic Agents","author":"Foye W. O.","year":"1995"},{"key":"ci050263ib00003\/ci050263ib00003_1","doi-asserted-by":"crossref","first-page":"2526","DOI":"10.1021\/cr0001030","volume":"101","author":"Harper J. W.","year":"2001","journal-title":"Chem. Rev."},{"key":"ci050263ib00004\/ci050263ib00004_1","doi-asserted-by":"crossref","first-page":"18","DOI":"10.1021\/jm990256j","volume":"43","author":"Sielecki T. M.","year":"2000","journal-title":"J. Med. Chem."},{"key":"ci050263ib00005\/ci050263ib00005_1","doi-asserted-by":"crossref","first-page":"842","DOI":"10.1016\/0955-0674(95)80067-0","volume":"7","author":"Zetterberg A.","year":"1995","journal-title":"Curr. Opin. Cell Biol."},{"key":"ci050263ib00006\/ci050263ib00006_1","doi-asserted-by":"crossref","first-page":"2999","DOI":"10.1200\/JCO.1998.16.9.2986","volume":"16","author":"Senderowicz A. M.","year":"1998","journal-title":"J. Clin. Oncol."},{"key":"ci050263ib00007\/ci050263ib00007_1","doi-asserted-by":"crossref","first-page":"536","DOI":"10.1111\/j.1432-1033.1997.t01-2-00527.x","volume":"243","author":"Meijer L.","year":"1997","journal-title":"Eur. J. Biochem."},{"key":"ci050263ib00008\/ci050263ib00008_1","doi-asserted-by":"crossref","first-page":"1728","DOI":"10.1021\/jm0305568","volume":"47","author":"Misra R. N.","year":"2004","journal-title":"J. Med. Chem."},{"key":"ci050263ib00009\/ci050263ib00009_1","doi-asserted-by":"crossref","first-page":"284","DOI":"10.1016\/S0163-7258(98)00057-6","volume":"82","author":"Meijer L.","year":"1999","journal-title":"Pharmacol. Ther."},{"key":"ci050263ib00010\/ci050263ib00010_1","doi-asserted-by":"crossref","first-page":"2804","DOI":"10.1021\/jm990628o","volume":"43","author":"Arris C. E.","year":"2000","journal-title":"J. Med. Chem."},{"key":"ci050263ib00011\/ci050263ib00011_1","first-page":"1675","volume":"47","author":"Wang S.","year":"2004","journal-title":"J. Med. Chem."},{"key":"ci050263ib00012\/ci050263ib00012_1","doi-asserted-by":"crossref","first-page":"486","DOI":"10.1002\/ardp.200300870","volume":"337","author":"Pies T.","year":"2004","journal-title":"Arch. Pharm. (Weinheim, Ger.)"},{"key":"ci050263ib00013\/ci050263ib00013_1","doi-asserted-by":"crossref","first-page":"30","DOI":"10.1016\/S0003-2670(00)80865-X","volume":"248","author":"Zupan J.","year":"1991","journal-title":"Anal. Chim. Acta"},{"key":"ci050263ib00014\/ci050263ib00014_1","doi-asserted-by":"crossref","first-page":"3277","DOI":"10.1016\/j.bmc.2005.02.038","volume":"13","author":"Fern\u00e1ndez M.","year":"2005","journal-title":"Bioorg. Med. Chem."},{"key":"ci050263ib00015\/ci050263ib00015_1","first-page":"2189","volume":"44","author":"Guha R.","year":"2004","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci050263ib00016\/ci050263ib00016_1","doi-asserted-by":"crossref","first-page":"5911","DOI":"10.1021\/jm020455u","volume":"47","author":"Markwalder J. A.","year":"2004","journal-title":"J. Med. Chem."},{"key":"ci050263ib00017\/ci050263ib00017_1","first-page":"220","volume":"10","author":"Stewart J. J. P","year":"1989","journal-title":"J. Comput. Chem."},{"key":"ci050263ib00018\/ci050263ib00018_1","volume-title":"version 6","author":"MOPAC"},{"key":"ci050263ib00019\/ci050263ib00019_1","volume-title":"version 2.1","author":"Todeschini R."},{"key":"ci050263ib00020\/ci050263ib00020_1","first-page":"3842","volume":"36","author":"Kruszewski J.","year":"1972","journal-title":"Tetrahedron Lett."},{"key":"ci050263ib00021\/ci050263ib00021_1","first-page":"1348","volume":"48","author":"Jug K","year":"1983","journal-title":"J. Org. Chem."},{"key":"ci050263ib00022\/ci050263ib00022_1","first-page":"382","volume":"35","author":"Randic M","year":"1995","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci050263ib00023\/ci050263ib00023_1","volume-title":"Molecular Connectivity in Structure\u2212Activity Analysis","author":"Kier L. B.","year":"1986"},{"key":"ci050263ib00024\/ci050263ib00024_1","doi-asserted-by":"crossref","first-page":"164","DOI":"10.1016\/S0924-2031(99)00014-4","volume":"19","author":"Hemmer M. C.","year":"1999","journal-title":"Vib. Spectrosc."},{"key":"ci050263ib00025\/ci050263ib00025_1","doi-asserted-by":"crossref","first-page":"344","DOI":"10.1021\/ci950164c","volume":"36","author":"Schuur J.","year":"1996","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci050263ib00026\/ci050263ib00026_1","doi-asserted-by":"crossref","first-page":"272","DOI":"10.1002\/cem.1180080405","volume":"8","author":"Todeschini R.","year":"1994","journal-title":"J. Chemom."},{"key":"ci050263ib00027\/ci050263ib00027_1","first-page":"692","volume":"42","author":"Consonni V.","year":"2002","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci050263ib00028\/ci050263ib00028_1","volume-title":"Adaption in natural and artificial systems","author":"Holland H.","year":"1975"},{"key":"ci050263ib00029\/ci050263ib00029_1","volume-title":"Applications of artificial intelligence in chemistry","author":"Cartwright H. M.","year":"1993"},{"key":"ci050263ib00030\/ci050263ib00030_1","first-page":"1530","volume":"39","author":"So S.","year":"1996","journal-title":"J. Med. Chem."},{"key":"ci050263ib00031\/ci050263ib00031_1","volume-title":"version 7.0","author":"MATLAB"},{"key":"ci050263ib00032\/ci050263ib00032_1","doi-asserted-by":"crossref","first-page":"199","DOI":"10.1021\/ci049766z","volume":"45","author":"Hemmateenejad B.","year":"2005","journal-title":"J. Chem. Inf. Model."},{"key":"ci050263ib00033\/ci050263ib00033_1","doi-asserted-by":"crossref","first-page":"908","DOI":"10.1021\/jm00165a005","volume":"33","author":"Aoyama T.","year":"1990","journal-title":"J. Med. Chem."},{"key":"ci050263ib00034\/ci050263ib00034_1","first-page":"447","volume":"4","author":"Mackay D. J. C.","year":"1992","journal-title":"Neural Comput."},{"key":"ci050263ib00034\/ci050263ib00034_2","first-page":"472","volume":"4","author":"Mackay D. J. C","year":"1992","journal-title":"Neural Comput."},{"key":"ci050263ib00035\/ci050263ib00035_1","doi-asserted-by":"crossref","first-page":"24","DOI":"10.1016\/S0893-6080(00)00098-8","volume":"14","author":"Lampinen J.","year":"2001","journal-title":"Neural Networks"},{"key":"ci050263ib00036\/ci050263ib00036_1","doi-asserted-by":"crossref","first-page":"3187","DOI":"10.1021\/jm980697n","volume":"42","author":"Burden F. R.","year":"1999","journal-title":"J. Med. Chem."},{"key":"ci050263ib00036\/ci050263ib00036_2","first-page":"111","volume":"2","author":"Winkler D. A.","year":"2004","journal-title":"Biosilico"},{"key":"ci050263ib00037\/ci050263ib00037_1","volume-title":"Proceedings of the 1997 International Joint Conference on Neural Networks; IEEE:\u2009 Houston","author":"Foresee F. D."},{"key":"ci050263ib00038\/ci050263ib00038_1","doi-asserted-by":"crossref","first-page":"1001","DOI":"10.1109\/34.58871","volume":"12","author":"Hansen L. K.","year":"1990","journal-title":"IEEE Trans. Pattern Anal. Machine Intell."},{"key":"ci050263ib00039\/ci050263ib00039_1","first-page":"238","volume-title":"Advances in Neural Information Processing Systems 7","author":"Krogh A.","year":"1995"},{"key":"ci050263ib00040\/ci050263ib00040_1","volume-title":"Data Analysis for Chemists:\u2009 Applications to QSAR and Chemical Product Design","author":"Livingstone D. J.","year":"1995"},{"key":"ci050263ib00041\/ci050263ib00041_1","doi-asserted-by":"crossref","first-page":"193","DOI":"10.1002\/qsar.19910100302","volume":"10","author":"Wold S","year":"1991","journal-title":"Quant. Struct.-Act. Relat."},{"key":"ci050263ib00042\/ci050263ib00042_1","doi-asserted-by":"crossref","first-page":"276","DOI":"10.1016\/S1093-3263(01)00123-1","volume":"20","author":"Golbraikh A.","year":"2002","journal-title":"Mol. Graph. Model."},{"key":"ci050263ib00043\/ci050263ib00043_1","doi-asserted-by":"crossref","first-page":"369","DOI":"10.1023\/A:1020869118689","volume":"16","author":"Golbraikh A.","year":"2002","journal-title":"J. Comput.-Aided Mol. Des."},{"key":"ci050263ib00044\/ci050263ib00044_1","first-page":"434","volume":"43","author":"Yan A.","year":"2003","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci050263ib00045\/ci050263ib00045_1","doi-asserted-by":"crossref","first-page":"14","DOI":"10.1016\/j.jmgm.2004.03.003","volume":"23","author":"Guha R.","year":"2004","journal-title":"J. Mol. Graph. Model."},{"key":"ci050263ib00046\/ci050263ib00046_1","first-page":"911","volume":"42","author":"Agrafiotis D. K.","year":"2002","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci050263ib00047\/ci050263ib00047_1","first-page":"87","volume":"18","author":"Yan A.","year":"2004","journal-title":"J. Comput.-Aided Mol. Des."},{"key":"ci050263ib00048\/ci050263ib00048_1","first-page":"375","volume":"41","author":"Sousa J. A.","year":"2001","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci050263ib00049\/ci050263ib00049_1","doi-asserted-by":"crossref","first-page":"69","DOI":"10.1007\/BF00337288","volume":"43","author":"Kohonen T","year":"1982","journal-title":"Biol. Cybern."}],"container-title":["Journal of Chemical Information and Modeling"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci050263i","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2021,9,22]],"date-time":"2021-09-22T11:55:37Z","timestamp":1632311737000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci050263i"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2005,10,15]]},"references-count":51,"journal-issue":{"issue":"6","published-print":{"date-parts":[[2005,11,1]]}},"alternative-id":["10.1021\/ci050263i"],"URL":"https:\/\/doi.org\/10.1021\/ci050263i","relation":{},"ISSN":["1549-9596","1549-960X"],"issn-type":[{"value":"1549-9596","type":"print"},{"value":"1549-960X","type":"electronic"}],"subject":[],"published":{"date-parts":[[2005,10,15]]}}}