{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,20]],"date-time":"2025-10-20T09:59:35Z","timestamp":1760954375720},"reference-count":34,"publisher":"American Chemical Society (ACS)","issue":"4","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Comput. Sci."],"published-print":{"date-parts":[[1996,1,1]]},"DOI":"10.1021\/ci950131x","type":"journal-article","created":{"date-parts":[[2002,7,26]],"date-time":"2002-07-26T06:00:31Z","timestamp":1027663231000},"page":"644-653","source":"Crossref","is-referenced-by-count":32,"title":["<sup>13<\/sup>C NMR Chemical Shift Prediction of sp<sup>2<\/sup> Carbon Atoms in Acyclic Alkenes Using Neural Networks"],"prefix":"10.1021","volume":"36","author":[{"given":"O.","family":"Ivanciuc","sequence":"first","affiliation":[{"name":"Department of Organic Chemistry, Faculty of Chemical Technology, University \u201cPolitehnica\u201d of Bucharest, Splaiul Independentei 313, 77206 Bucharest, Romania, LARTIC University of Nice-Sophia Antipolis, Parc Valrose 06108 Nice Cedex, France, and ITODYS, University of Paris 7 - Denis Diderot, 1 Rue Guy de la Brosse, 75005 Paris, France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"J.-P.","family":"Rabine","sequence":"additional","affiliation":[{"name":"Department of Organic Chemistry, Faculty of Chemical Technology, University \u201cPolitehnica\u201d of Bucharest, Splaiul Independentei 313, 77206 Bucharest, Romania, LARTIC University of Nice-Sophia Antipolis, Parc Valrose 06108 Nice Cedex, France, and ITODYS, University of Paris 7 - Denis Diderot, 1 Rue Guy de la Brosse, 75005 Paris, France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"D.","family":"Cabrol-Bass","sequence":"additional","affiliation":[{"name":"Department of Organic Chemistry, Faculty of Chemical Technology, University \u201cPolitehnica\u201d of Bucharest, Splaiul Independentei 313, 77206 Bucharest, Romania, LARTIC University of Nice-Sophia Antipolis, Parc Valrose 06108 Nice Cedex, France, and ITODYS, University of Paris 7 - Denis Diderot, 1 Rue Guy de la Brosse, 75005 Paris, France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"A.","family":"Panaye","sequence":"additional","affiliation":[{"name":"Department of Organic Chemistry, Faculty of Chemical Technology, University \u201cPolitehnica\u201d of Bucharest, Splaiul Independentei 313, 77206 Bucharest, Romania, LARTIC University of Nice-Sophia Antipolis, Parc Valrose 06108 Nice Cedex, France, and ITODYS, University of Paris 7 - Denis Diderot, 1 Rue Guy de la Brosse, 75005 Paris, France"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"J. P.","family":"Doucet","sequence":"additional","affiliation":[{"name":"Department of Organic Chemistry, Faculty of Chemical Technology, University \u201cPolitehnica\u201d of Bucharest, Splaiul Independentei 313, 77206 Bucharest, Romania, LARTIC University of Nice-Sophia Antipolis, Parc Valrose 06108 Nice Cedex, France, and ITODYS, University of Paris 7 - Denis Diderot, 1 Rue Guy de la Brosse, 75005 Paris, France"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[1996,7,24]]},"reference":[{"key":"ci950131xb00001\/ci950131xb00001_1","doi-asserted-by":"crossref","first-page":"108","DOI":"10.1021\/ci00046a010","volume":"25","author":"Kalchhauser H.","year":"1985","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci950131xb00002\/ci950131xb00002_1","doi-asserted-by":"crossref","first-page":"223","DOI":"10.1016\/0169-7439(93)80105-Q","volume":"19","author":"Chen L.","year":"1993","journal-title":"Chemom. Intell. Lab. Syst."},{"key":"ci950131xb00003\/ci950131xb00003_1","doi-asserted-by":"crossref","first-page":"2990","DOI":"10.1021\/ja01069a005","volume":"86","author":"Grant D. M.","year":"1964","journal-title":"J. Am. Chem. Soc."},{"key":"ci950131xb00004\/ci950131xb00004_1","first-page":"1370","volume":"50","author":"Brouwer H.","year":"1972","journal-title":"Can. J. Chem."},{"key":"ci950131xb00005\/ci950131xb00005_1","doi-asserted-by":"crossref","first-page":"25","DOI":"10.1016\/S0003-2670(00)85105-3","volume":"229","author":"F\u00fcrst A.","year":"1990","journal-title":"Anal. Chim. Acta"},{"key":"ci950131xb00006\/ci950131xb00006_1","doi-asserted-by":"crossref","first-page":"222","DOI":"10.1016\/S0003-2670(00)83481-9","volume":"233","author":"F\u00fcrst A.","year":"1990","journal-title":"Anal. Chim. Acta"},{"key":"ci950131xb00007\/ci950131xb00007_1","doi-asserted-by":"crossref","first-page":"428","DOI":"10.1016\/S0003-2670(00)84659-0","volume":"248","author":"Pretsch E.","year":"1991","journal-title":"Anal. Chim. Acta"},{"key":"ci950131xb00008\/ci950131xb00008_1","doi-asserted-by":"crossref","first-page":"295","DOI":"10.1021\/ci00008a005","volume":"32","author":"Pretsch E.","year":"1992","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci950131xb00009\/ci950131xb00009_1","doi-asserted-by":"crossref","first-page":"235","DOI":"10.1016\/0003-2670(94)85025-9","volume":"285","author":"Cheng H. N.","year":"1994","journal-title":"Anal. Chim. Acta"},{"key":"ci950131xb00010\/ci950131xb00010_1","doi-asserted-by":"crossref","first-page":"265","DOI":"10.1021\/ci00012a012","volume":"33","author":"Panaye A.","year":"1993","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci950131xb00011\/ci950131xb00011_1","first-page":"278","volume":"32","author":"Jurs P. C.","year":"1992","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci950131xb00012\/ci950131xb00012_1","doi-asserted-by":"crossref","first-page":"76","DOI":"10.1007\/BF01192574","volume":"6","author":"Kvasnicka V","year":"1991","journal-title":"J. Math. Chem."},{"key":"ci950131xb00013\/ci950131xb00013_1","doi-asserted-by":"crossref","first-page":"324","DOI":"10.1021\/ci00013a007","volume":"33","author":"Doucet J. P.","year":"1993","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci950131xb00014\/ci950131xb00014_1","doi-asserted-by":"crossref","first-page":"135","DOI":"10.1016\/0169-7439(94)00022-0","volume":"24","author":"Panaye A.","year":"1994","journal-title":"Chemom. Intell. Lab. Syst."},{"key":"ci950131xb00015\/ci950131xb00015_1","first-page":"1101","volume":"40","author":"Ivanciuc O","year":"1995","journal-title":"Rev. Roum. Chim."},{"key":"ci950131xb00016\/ci950131xb00016_1","doi-asserted-by":"crossref","first-page":"747","DOI":"10.1021\/ci00010a023","volume":"32","author":"Kvasnicka V.","year":"1992","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci950131xb00017\/ci950131xb00017_1","doi-asserted-by":"crossref","first-page":"107","DOI":"10.1016\/0166-1280(92)87132-J","volume":"277","author":"Kvasnicka V.","year":"1992","journal-title":"J. Mol. Struct. (Theochem)"},{"key":"ci950131xb00018\/ci950131xb00018_1","doi-asserted-by":"crossref","first-page":"1164","DOI":"10.1021\/ac00034a015","volume":"64","author":"Anker L. S.","year":"1992","journal-title":"Anal. Chem."},{"key":"ci950131xb00019\/ci950131xb00019_1","doi-asserted-by":"crossref","first-page":"245","DOI":"10.1016\/S0166-1280(09)80062-6","volume":"311","author":"Miyashita Y.","year":"1994","journal-title":"J. Mol. Struct. (Theochem)"},{"key":"ci950131xb00020\/ci950131xb00020_1","first-page":"589","volume":"33","author":"West G. M. J","year":"1993","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci950131xb00021\/ci950131xb00021_1","first-page":"30","volume":"35","author":"West G. M. J","year":"1995","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci950131xb00022\/ci950131xb00022_1","doi-asserted-by":"crossref","DOI":"10.7551\/mitpress\/5236.001.0001","volume-title":"Parallel Distributed Processing","author":"Rumelhart D. E.","year":"1986"},{"key":"ci950131xb00023\/ci950131xb00023_1","volume-title":"Neural Computing. Theory and Practice","author":"Wasserman P. D.","year":"1989"},{"key":"ci950131xb00024\/ci950131xb00024_1","volume-title":"Neural Networks for Chemists","author":"Zupan J.","year":"1993"},{"key":"ci950131xb00025\/ci950131xb00025_1","doi-asserted-by":"crossref","first-page":"527","DOI":"10.1002\/anie.199305031","volume":"32","author":"Gasteiger J.","year":"1993","journal-title":"Angew. Chem., Int. Ed. Engl."},{"key":"ci950131xb00026\/ci950131xb00026_1","doi-asserted-by":"crossref","first-page":"155","DOI":"10.1016\/0169-7439(93)80052-J","volume":"18","author":"Wythoff B. J","year":"1993","journal-title":"Chemom. Intell. Lab. Syst."},{"key":"ci950131xb00027\/ci950131xb00027_1","first-page":"189","volume":"22","author":"Smits J. R. M.","year":"1994","journal-title":"Chemom. Intell. Lab. Syst."},{"key":"ci950131xb00028\/ci950131xb00028_1","author":"Ivanciuc O","year":"1996","journal-title":"Croat. Chem. Acta"},{"key":"ci950131xb00029\/ci950131xb00029_1","author":"Ivanciuc O","year":"1996","journal-title":"Croat. Chem. Acta"},{"key":"ci950131xb00030\/ci950131xb00030_1","doi-asserted-by":"crossref","first-page":"536","DOI":"10.1038\/323533a0","volume":"323","author":"Rumelhart D. E.","year":"1986","journal-title":"Nature"},{"key":"ci950131xb00031\/ci950131xb00031_1","doi-asserted-by":"crossref","first-page":"804A","DOI":"10.1021\/ac00093a044","volume":"66","author":"Thomas E. V","year":"1994","journal-title":"Anal. Chem."},{"key":"ci950131xb00032\/ci950131xb00032_1","doi-asserted-by":"crossref","first-page":"366","DOI":"10.1016\/0893-6080(89)90020-8","volume":"2","author":"Hornik K.","year":"1989","journal-title":"Neural Networks"},{"key":"ci950131xb00033\/ci950131xb00033_1","doi-asserted-by":"crossref","first-page":"2836","DOI":"10.1021\/jm00113a022","volume":"34","author":"Andrea T. A.","year":"1991","journal-title":"J. Med. Chem."},{"key":"ci950131xb00034\/ci950131xb00034_1","doi-asserted-by":"crossref","first-page":"1297","DOI":"10.1021\/jm00061a023","volume":"36","author":"Livingstone D. J.","year":"1993","journal-title":"J. Med. Chem."}],"container-title":["Journal of Chemical Information and Computer Sciences"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci950131x","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2021,9,23]],"date-time":"2021-09-23T16:47:49Z","timestamp":1632415669000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci950131x"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[1996,1,1]]},"references-count":34,"journal-issue":{"issue":"4","published-print":{"date-parts":[[1996,1,1]]}},"alternative-id":["10.1021\/ci950131x"],"URL":"https:\/\/doi.org\/10.1021\/ci950131x","relation":{},"ISSN":["0095-2338"],"issn-type":[{"value":"0095-2338","type":"print"}],"subject":[],"published":{"date-parts":[[1996,1,1]]}}}