{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2023,3,5]],"date-time":"2023-03-05T19:49:23Z","timestamp":1678045763824},"reference-count":29,"publisher":"Elsevier BV","issue":"3","license":[{"start":{"date-parts":[[1997,1,1]],"date-time":"1997-01-01T00:00:00Z","timestamp":852076800000},"content-version":"tdm","delay-in-days":0,"URL":"https:\/\/www.elsevier.com\/tdm\/userlicense\/1.0\/"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":["Computers &amp; Chemistry"],"published-print":{"date-parts":[[1997,1]]},"DOI":"10.1016\/s0097-8485(96)00032-0","type":"journal-article","created":{"date-parts":[[2002,7,26]],"date-time":"2002-07-26T02:58:12Z","timestamp":1027652292000},"page":"143-151","source":"Crossref","is-referenced-by-count":5,"title":["The accurate computation of partition functions in non-rigid molecules"],"prefix":"10.1016","volume":"21","author":[{"given":"Alfonso","family":"Ni\u00f1o","sequence":"first","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]},{"given":"Camelia","family":"Mu\u00f1oz-Caro","sequence":"additional","affiliation":[],"role":[{"role":"author","vocabulary":"crossref"}]}],"member":"78","reference":[{"key":"10.1016\/S0097-8485(96)00032-0_BIB1","doi-asserted-by":"crossref","first-page":"1819","DOI":"10.1021\/j100342a026","volume":"93","author":"Boatz","year":"1989","journal-title":"Journal of Physical Chemistry"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB2","author":"Brainerd","year":"1990"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB3","doi-asserted-by":"crossref","first-page":"76","DOI":"10.1093\/imamat\/6.1.76","volume":"6","author":"Broyden","year":"1970","journal-title":"Journal of the Institute of Mathematical Applications"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB4","first-page":"11","volume":"40","author":"Cohen","year":"1987","journal-title":"Physics Today"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB5","series-title":"Applied Regression Analysis","author":"Draper","year":"1981"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB6","doi-asserted-by":"crossref","first-page":"317","DOI":"10.1093\/comjnl\/13.3.317","volume":"13","author":"Fletcher","year":"1970","journal-title":"Computer Journal"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB7","author":"Frisch","year":"1995"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB8","doi-asserted-by":"crossref","first-page":"23","DOI":"10.1090\/S0025-5718-1970-0258249-6","volume":"24","author":"Goldfard","year":"1970","journal-title":"Mathematics and Computers"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB9","doi-asserted-by":"crossref","first-page":"4231","DOI":"10.1021\/j100266a017","volume":"89","author":"Harthcock","year":"1985","journal-title":"Journal of Physical Chemistry"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB10","volume":"Vol. II","author":"Levine","year":"1970"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB11","series-title":"Applied Statistical Thermodynamics","author":"Lucas","year":"1991"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB12","series-title":"Statistical Mechanics","author":"McQuarrie","year":"1973"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB13","doi-asserted-by":"crossref","first-page":"27","DOI":"10.1016\/0097-8485(94)80020-0","volume":"18","author":"Ni\u00f1o","year":"1994","journal-title":"Computers and Chemistry"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB14","doi-asserted-by":"crossref","first-page":"371","DOI":"10.1016\/0097-8485(95)00035-Q","volume":"19","author":"Ni\u00f1o","year":"1995","journal-title":"Computers and Chemistry"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB15","volume":"Vol. 17","author":"Ni\u00f1o","year":"1997","journal-title":"Quantum Chemistry Program Exchange"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB16","doi-asserted-by":"crossref","first-page":"8510","DOI":"10.1021\/j100021a010","volume":"99","author":"Ni\u00f1o","year":"1995","journal-title":"Journal of Physical Chemistry"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB17","series-title":"Introduction to Quantum Mechanics","author":"Pauling","year":"1935"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB18","doi-asserted-by":"crossref","first-page":"1715","DOI":"10.1063\/1.1677430","volume":"56","author":"Pickett","year":"1972","journal-title":"Journal of Chemical Physics"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB19","series-title":"Numerical Recipes. The Art of Scientific Computing","author":"Press","year":"1986"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB20","doi-asserted-by":"crossref","first-page":"791","DOI":"10.1080\/00268979000100601","volume":"69","author":"Quack","year":"1990","journal-title":"Molecular Physics"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB21","doi-asserted-by":"crossref","first-page":"28","DOI":"10.1063\/1.461486","volume":"95","author":"Quack","year":"1991","journal-title":"Journal of Chemical Physics"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB22","first-page":"61","volume":"93","author":"Quack","year":"1996","journal-title":"Theoretica Chimica Acta"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB23","series-title":"Quantum Pharmacology","author":"Richards","year":"1983"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB24","volume":"Vol. II","author":"Scheiner","year":"1991"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB25","doi-asserted-by":"crossref","first-page":"134","DOI":"10.1002\/jcc.540141112","volume":"14","author":"Schmidt","year":"1993","journal-title":"Journal of Computational Chemistry"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB26","doi-asserted-by":"crossref","first-page":"647","DOI":"10.1090\/S0025-5718-1970-0274029-X","volume":"24","author":"Shanno","year":"1970","journal-title":"Mathematics and Computers"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB27","series-title":"Data Structures","author":"Smith","year":"1987"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB28","doi-asserted-by":"crossref","first-page":"243","DOI":"10.1103\/PhysRev.34.243","volume":"34","author":"Wang","year":"1929","journal-title":"Physical Review"},{"key":"10.1016\/S0097-8485(96)00032-0_BIB29","article-title":"Molecular conformation and structure-activity relationships","volume":"Vol. 367","author":"Weinstein","year":"1981"}],"container-title":["Computers &amp; Chemistry"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0097848596000320?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0097848596000320?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2019,4,14]],"date-time":"2019-04-14T01:59:37Z","timestamp":1555207177000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0097848596000320"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[1997,1]]},"references-count":29,"journal-issue":{"issue":"3","published-print":{"date-parts":[[1997,1]]}},"alternative-id":["S0097848596000320"],"URL":"https:\/\/doi.org\/10.1016\/s0097-8485(96)00032-0","relation":{},"ISSN":["0097-8485"],"issn-type":[{"value":"0097-8485","type":"print"}],"subject":[],"published":{"date-parts":[[1997,1]]}}}