{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2025,10,20]],"date-time":"2025-10-20T16:20:08Z","timestamp":1760977208152},"reference-count":39,"publisher":"American Chemical Society (ACS)","issue":"5","content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["J. Chem. Inf. Comput. Sci."],"published-print":{"date-parts":[[2000,9,1]]},"DOI":"10.1021\/ci000021c","type":"journal-article","created":{"date-parts":[[2002,7,26]],"date-time":"2002-07-26T05:59:58Z","timestamp":1027663198000},"page":"1169-1176","source":"Crossref","is-referenced-by-count":65,"title":["Fast Determination of <sup>13<\/sup>C NMR Chemical Shifts Using Artificial Neural Networks"],"prefix":"10.1021","volume":"40","author":[{"given":"J.","family":"Meiler","sequence":"first","affiliation":[{"name":"Institute of Organic Chemistry, Marie - Curie - Strasse 11, University of Frankfurt, D-60439 Frankfurt, Germany, Institute of Organic Chemistry, University of Mainz, D-55099 Mainz, Germany, and BASF AG Ludwigshafen, D-67056 Ludwigshafen, Germany"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"R.","family":"Meusinger","sequence":"additional","affiliation":[{"name":"Institute of Organic Chemistry, Marie - Curie - Strasse 11, University of Frankfurt, D-60439 Frankfurt, Germany, Institute of Organic Chemistry, University of Mainz, D-55099 Mainz, Germany, and BASF AG Ludwigshafen, D-67056 Ludwigshafen, Germany"}],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"M.","family":"Will","sequence":"additional","affiliation":[{"name":"Institute of Organic Chemistry, Marie - Curie - Strasse 11, University of Frankfurt, D-60439 Frankfurt, Germany, Institute of Organic Chemistry, University of Mainz, D-55099 Mainz, Germany, and BASF AG Ludwigshafen, D-67056 Ludwigshafen, Germany"}],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"316","published-online":{"date-parts":[[2000,8,25]]},"reference":[{"key":"ci000021cb00001\/ci000021cb00001_1","doi-asserted-by":"crossref","first-page":"158","DOI":"10.1016\/S0079-6565(98)00025-9","volume":"34","author":"Sattler M.","year":"1999","journal-title":"Prog. Nucl. Magn. Reson. Spectrosc."},{"key":"ci000021cb00002\/ci000021cb00002_1","first-page":"1009","volume":"38","author":"Munk E. M","year":"1998","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci000021cb00003\/ci000021cb00003_1","first-page":"577","volume":"3","author":"Lindel T.","year":"1938","journal-title":"Eur. J. Org. Chem."},{"key":"ci000021cb00004\/ci000021cb00004_1","first-page":"819","volume":"34","author":"Peng C.","year":"1994","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci000021cb00005\/ci000021cb00005_1","doi-asserted-by":"crossref","first-page":"278","DOI":"10.1002\/(SICI)1097-458X(199804)36:4<267::AID-OMR256>3.0.CO;2-6","volume":"36","author":"Peng C.","year":"1998","journal-title":"Magn. Reson. Chem."},{"key":"ci000021cb00006\/ci000021cb00006_1","first-page":"177","volume":"95","author":"Nuzillard J. M","year":"1998","journal-title":"J. Chim. Phys.-Chim. Biol."},{"key":"ci000021cb00007\/ci000021cb00007_1","volume-title":"Carbon-13 NMR Chemical Shifts in Structural and Stereochemical Analysis","author":"Pihlaja K.","year":"1994"},{"key":"ci000021cb00008\/ci000021cb00008_1","first-page":"365","volume":"103","author":"Bremser W.","year":"1973","journal-title":"Anal. Chim. Acta"},{"key":"ci000021cb00010\/ci000021cb00010_1","volume-title":"Carbon-13 NMR Spectral Data","author":"Bremser W.","year":"1981"},{"key":"ci000021cb00012\/ci000021cb00012_1","doi-asserted-by":"crossref","first-page":"411","DOI":"10.1021\/ci00025a008","volume":"35","author":"Trepalin S. V.","year":"1995","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci000021cb00014\/ci000021cb00014_1","first-page":"1933","volume":"76","author":"Schindler M.","year":"1982","journal-title":"J. Chem. Phys."},{"key":"ci000021cb00015\/ci000021cb00015_1","doi-asserted-by":"crossref","DOI":"10.1007\/978-3-662-10205-3","volume-title":"Tabellen zur Strukturaufkl\u00e4rung organischer Verbindungen mit spektroskopischen Methoden","author":"Pretsch E.","year":"1981"},{"key":"ci000021cb00016\/ci000021cb00016_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":"ci000021cb00017\/ci000021cb00017_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":"ci000021cb00018\/ci000021cb00018_1","doi-asserted-by":"crossref","first-page":"524","DOI":"10.1002\/mrc.1270120902","volume":"12","author":"Ewing D.","year":"1979","journal-title":"Org. Magn. Reson."},{"key":"ci000021cb00019\/ci000021cb00019_1","doi-asserted-by":"crossref","first-page":"729","DOI":"10.1021\/ci00020a005","volume":"34","author":"Thomas S.","year":"1994","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci000021cb00020\/ci000021cb00020_1","doi-asserted-by":"crossref","unstructured":"Gloor, A., Cadisch, M.; B\u00fcrgin-Schaller, R.; Farkas, M.; Kocsis, T.; Clerc, J. T.; Pretsch, E.; Aeschimann, R.; Badertscher, M.; Brodmeier, T.; F\u00fcrst, A.; Hediger, H.J.; Junghans, M.; Kubinyi, H.; Munk, M. E.; Schriber, H.; Wegmann, D.SpecTool:\u2009 A Hypermedia Book for Structure Elucidation ofOrganic Compounds using Spectroscopic Methods; Chemical Concepts:\u2009 Weinheim, 1994.","DOI":"10.1016\/0003-2670(94)80338-2"},{"key":"ci000021cb00021\/ci000021cb00021_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":"ci000021cb00022\/ci000021cb00022_1","first-page":"1095","volume":"130","author":"Meiler J.","year":"1999","journal-title":"Monatsh. Chem.\/Chem. Monthly"},{"key":"ci000021cb00023\/ci000021cb00023_1","doi-asserted-by":"crossref","first-page":"2601","DOI":"10.1021\/cr00024a001","volume":"93","author":"Burns J. A.","year":"1993","journal-title":"Chem. Rev."},{"key":"ci000021cb00024\/ci000021cb00024_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":"ci000021cb00025\/ci000021cb00025_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":"ci000021cb00026\/ci000021cb00026_1","first-page":"140","volume":"48","author":"Sklenak S.","year":"1994","journal-title":"Chem. Papers"},{"key":"ci000021cb00027\/ci000021cb00027_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":"ci000021cb00028\/ci000021cb00028_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":"ci000021cb00029\/ci000021cb00029_1","doi-asserted-by":"crossref","first-page":"928","DOI":"10.1021\/ci00027a021","volume":"35","author":"Svozil D.","year":"1995","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci000021cb00030\/ci000021cb00030_1","doi-asserted-by":"crossref","first-page":"62","DOI":"10.1016\/S0169-7439(97)00061-0","volume":"39","author":"Svozil D.","year":"1997","journal-title":"Chemom. Intell. Lab. Syst."},{"key":"ci000021cb00031\/ci000021cb00031_1","doi-asserted-by":"crossref","first-page":"443","DOI":"10.1016\/S0097-8485(97)00019-3","volume":"21","author":"Ivanciuc O.","year":"1997","journal-title":"Computers Chem."},{"key":"ci000021cb00032\/ci000021cb00032_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":"ci000021cb00033\/ci000021cb00033_1","first-page":"653","volume":"36","author":"Ivanciuc O.","year":"1996","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci000021cb00034\/ci000021cb00034_1","first-page":"598","volume":"37","author":"Ivanciuc O.","year":"1997","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci000021cb00035\/ci000021cb00035_1","doi-asserted-by":"crossref","first-page":"507","DOI":"10.1002\/prac.199533701106","volume":"337","author":"Thomas S.","year":"1995","journal-title":"J. Prakt. Chem.\/Chem.-Ztg."},{"key":"ci000021cb00036\/ci000021cb00036_1","doi-asserted-by":"crossref","first-page":"77","DOI":"10.1016\/0008-6215(95)00051-T","volume":"271","author":"Clouser D. L.","year":"1995","journal-title":"Carbohydr. Res."},{"key":"ci000021cb00037\/ci000021cb00037_1","doi-asserted-by":"crossref","first-page":"135","DOI":"10.1016\/0003-2670(95)00581-1","volume":"321","author":"Clouser D. L.","year":"1996","journal-title":"Anal. Chim. Acta"},{"key":"ci000021cb00038\/ci000021cb00038_1","doi-asserted-by":"crossref","first-page":"172","DOI":"10.1021\/ci950055y","volume":"36","author":"Clouser D. L.","year":"1996","journal-title":"J. Chem. Inf. Comput. Sci."},{"key":"ci000021cb00039\/ci000021cb00039_1","doi-asserted-by":"crossref","first-page":"78","DOI":"10.1016\/S0169-7439(98)00148-8","volume":"46","author":"Meusinger R.","year":"1999","journal-title":"Chemom. Intell. Lab. Syst."},{"key":"ci000021cb00040\/ci000021cb00040_1","volume-title":"Smart","author":"Meiler J.","year":"1998"},{"key":"ci000021cb00041\/ci000021cb00041_1","unstructured":"Meiler, J. C_Shift;http:\/\/www.krypton.org.uni-frankfurt.de\/\u223cmj, 1999."},{"key":"ci000021cb00042\/ci000021cb00042_1","doi-asserted-by":"crossref","first-page":"1569","DOI":"10.1002\/anie.199615671","volume":"35","author":"H\u00f6fle G.","year":"1996","journal-title":"Angew. Chem. Int. Ed. Engl."}],"container-title":["Journal of Chemical Information and Computer Sciences"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/pubs.acs.org\/doi\/pdf\/10.1021\/ci000021c","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2021,10,10]],"date-time":"2021-10-10T22:27:46Z","timestamp":1633904866000},"score":1,"resource":{"primary":{"URL":"https:\/\/pubs.acs.org\/doi\/10.1021\/ci000021c"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2000,8,25]]},"references-count":39,"journal-issue":{"issue":"5","published-print":{"date-parts":[[2000,9,1]]}},"alternative-id":["10.1021\/ci000021c"],"URL":"https:\/\/doi.org\/10.1021\/ci000021c","relation":{},"ISSN":["0095-2338"],"issn-type":[{"value":"0095-2338","type":"print"}],"subject":[],"published":{"date-parts":[[2000,8,25]]}}}