{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2024,9,4]],"date-time":"2024-09-04T22:09:10Z","timestamp":1725487750057},"publisher-location":"Berlin, Heidelberg","reference-count":25,"publisher":"Springer Berlin Heidelberg","isbn-type":[{"type":"print","value":"9783540401971"},{"type":"electronic","value":"9783540448648"}],"content-domain":{"domain":[],"crossmark-restriction":false},"short-container-title":[],"published-print":{"date-parts":[[2003]]},"DOI":"10.1007\/3-540-44864-0_108","type":"book-chapter","created":{"date-parts":[[2007,7,16]],"date-time":"2007-07-16T15:09:48Z","timestamp":1184598588000},"page":"1040-1049","source":"Crossref","is-referenced-by-count":0,"title":["A New Method for Locating the Global Optimum: Application of the Cutting Angle Method to Molecular Structure Prediction"],"prefix":"10.1007","author":[{"given":"Kieran F.","family":"Lim","sequence":"first","affiliation":[]},{"given":"Gleb","family":"Beliakov","sequence":"additional","affiliation":[]},{"given":"Lynn","family":"Batten","sequence":"additional","affiliation":[]}],"member":"297","published-online":{"date-parts":[[2003,6,18]]},"reference":[{"key":"108_CR1","volume-title":"Chemometrics in Analytical Spectroscopy","author":"M. J. Adams","year":"1995","unstructured":"M. J. Adams, Chemometrics in Analytical Spectroscopy, Royal Society of Chemistry, London (1995)"},{"key":"108_CR2","first-page":"1667","volume":"43","author":"A. Cladera","year":"1996","unstructured":"A. Cladera, E. Gomez, J. M. Estela and V. Cerda, Effect of Variables Influencing S-1\/2 in Sequential Injection Analysis \u2014 Extrapolability of S-1\/2 Based Results Between SIA Designs, Talanta, 43 (1996), 1667\u20131674","journal-title":"Effect of Variables Influencing S-1\/2 in Sequential Injection Analysis \u2014 Extrapolability of S-1\/2 Based Results Between SIA Designs, Talanta"},{"key":"108_CR3","doi-asserted-by":"publisher","first-page":"167","DOI":"10.1007\/s002160051051","volume":"362","author":"S. M. Sultan","year":"1998","unstructured":"S. M. Sultan, A. M. Almuaibed and A. Townshend, Flow injection chemiluminescence determination of medazepam, Fresenius Journal of Analytical Chemistry, 362 (1998), 167\u2013169","journal-title":"Fresenius Journal of Analytical Chemistry"},{"key":"108_CR4","doi-asserted-by":"publisher","first-page":"1041","DOI":"10.1039\/a708350e","volume":"123","author":"A. Townshend","year":"1998","unstructured":"A. Townshend and R. A. Wheatly, Oxidative chemiluminescence assay of 2,4-dinitrophenylhydrazine, Analyst, 123 (1998), 1041\u20131046","journal-title":"Analyst"},{"key":"108_CR5","doi-asserted-by":"publisher","first-page":"141","DOI":"10.1002\/9780470125939.ch3","volume-title":"Reviews in Computational Chemistry","author":"J.-R. Hill","year":"2000","unstructured":"J.-R. Hill, C. M. Freeman and L. Subramanian, Use of force fields in materials modeling, in K. B. Lipkowitz and D. B. Boyd, eds., Reviews in Computational Chemistry, Wiley-VCH, New York, 2000, 141\u2013216"},{"key":"108_CR6","doi-asserted-by":"publisher","first-page":"2439","DOI":"10.1021\/cr00023a006","volume":"93","author":"J. E. Eksterowicz","year":"1993","unstructured":"J. E. Eksterowicz and K. N. Houk, Transition state modeling with empirical force fields, Chemical Reviews, 93 (1993), 2439\u20132461","journal-title":"Chemical Reviews"},{"key":"108_CR7","doi-asserted-by":"publisher","first-page":"407","DOI":"10.1137\/S0036144594278060","volume":"39","author":"A. Neumaier","year":"1997","unstructured":"A. Neumaier, Molecular modeling of proteins and mathematical prediction of protein structure, SIAM Review, 39 (1997), 407\u2013460","journal-title":"SIAM Review"},{"key":"108_CR8","volume-title":"Optimization in computational chemistry and molecular biology: local and global approaches","author":"P. M. Pardalos","year":"2000","unstructured":"P. M. Pardalos and C. A. Floudas, Optimization in computational chemistry and molecular biology: local and global approaches, Kluwer Academic Publishers, Boston (2000)"},{"key":"108_CR9","doi-asserted-by":"publisher","first-page":"9725","DOI":"10.1021\/jp982255t","volume":"102","author":"R. V. Pappu","year":"1998","unstructured":"R. V. Pappu, R. K. Hart and J. W. Ponder, Analysis and application of potential energy smoothing and search methods for global optimization, Journal of Physical Chemistry B, 102 (1998), 9725\u20139742","journal-title":"Journal of Physical Chemistry B"},{"key":"108_CR10","volume-title":"Computer Simulations of Liquids","author":"M. P. Allen","year":"1990","unstructured":"M. P. Allen and D. J. Tildesley, Computer Simulations of Liquids, Oxford Science Publications, Oxford (1990)"},{"key":"108_CR11","doi-asserted-by":"crossref","DOI":"10.1007\/978-1-4757-4949-6","volume-title":"Deterministic global optimization: Theory, methods, and applications","author":"C. A. Floudas","year":"2000","unstructured":"C. A. Floudas, Deterministic global optimization: Theory, methods, and applications, Kluwer Academic Publishers, Dordrecht; London (2000)"},{"key":"108_CR12","doi-asserted-by":"crossref","DOI":"10.1007\/978-1-4615-2025-2","volume-title":"Handbook of global optimization","author":"R. Horst","year":"1995","unstructured":"R. Horst and P. M. Pardalos, Handbook of global optimization, Kluwer Academic Publishers, Dordrecht; Boston (1995)"},{"key":"108_CR13","doi-asserted-by":"publisher","first-page":"95","DOI":"10.1016\/S0893-9659(98)00179-7","volume":"12","author":"M. Andramonov","year":"1999","unstructured":"M. Andramonov, A. Rubinov and B. Glover, Cutting angle methods in global optimization, Applied Mathematics Letters, 12 (1999), 95\u2013100","journal-title":"Applied Mathematics Letters"},{"key":"108_CR14","doi-asserted-by":"publisher","first-page":"171","DOI":"10.1023\/A:1019204407420","volume":"98","author":"A. Bagirov","year":"2000","unstructured":"A. Bagirov and A. Rubinov, Global minimization of increasing positively homogeneous function over the unit simplex, Annals of Operations Research, 98 (2000), 171\u2013187","journal-title":"Annals of Operations Research"},{"key":"108_CR15","doi-asserted-by":"crossref","DOI":"10.1007\/978-1-4757-3200-9","volume-title":"Abstract convexity and global optimization","author":"A. M. Rubinov","year":"2000","unstructured":"A. M. Rubinov, Abstract convexity and global optimization, Kluwer Academic Publishers, Dordrecht; Boston (2000)"},{"key":"108_CR16","doi-asserted-by":"crossref","unstructured":"A. Bagirov and A. Rubinov, Modified versions of the cutting angle method, in N. Hadjisavvas and P. M. Pardalos, eds., Convex analysis and global optimization, Kluwer, Dordrecht, 2001, 245\u2013268","DOI":"10.1007\/978-1-4613-0279-7_13"},{"key":"108_CR17","doi-asserted-by":"crossref","unstructured":"P. Hansen and B. Jaumard, Lipschitz optimization, in R. Horst and P. Pardalos, eds., Handbook of global optimization, Kluwer, Dordrecht, 1995, 407\u2013493","DOI":"10.1007\/978-1-4615-2025-2_9"},{"key":"108_CR18","doi-asserted-by":"publisher","first-page":"149","DOI":"10.1023\/A:1020256900863","volume":"24","author":"L. M. Batten","year":"2002","unstructured":"L. M. Batten and G. Beliakov, Fast algorithm for the cutting angle method of global optimization, Journal of Global Optimization, 24 (2002), 149\u2013161","journal-title":"Journal of Global Optimization"},{"key":"108_CR19","doi-asserted-by":"publisher","first-page":"441","DOI":"10.1002\/9780470125915.ch7","volume-title":"Reviews in Computational Chemistry","author":"M. Jalaie","year":"2000","unstructured":"M. Jalaie and K. B. Lipkowitz, Published force field parameters for molecular mechanics, molecular dynamics, and Monte Carlo simulations, in K. B. Lipkowitz and D. B. Boyd, eds., Reviews in Computational Chemistry, Wiley-VCH, New York, 2000, 441\u2013486"},{"key":"108_CR20","doi-asserted-by":"publisher","first-page":"549","DOI":"10.1080\/00268978500101531","volume":"55","author":"J.-P. Ryckaert","year":"1985","unstructured":"J.-P. Ryckaert, Special geometrical constraints in the molecular dynamics of chain molecules, Mol. Phys., 55 (1985), 549\u2013556","journal-title":"Mol. Phys."},{"key":"108_CR21","doi-asserted-by":"crossref","first-page":"345","DOI":"10.1016\/0167-7977(86)90022-5","volume":"4","author":"C. Ciccotti","year":"1986","unstructured":"C. Ciccotti and J.-P. Ryckaert, Molecular dynamics simulations of rigid molecules, Comput. Phys. Reports, 4 (1986), 345\u2013392","journal-title":"Comput. Phys. Reports"},{"key":"108_CR22","doi-asserted-by":"publisher","first-page":"75","DOI":"10.1002\/9780470125892.ch2","volume-title":"Reviews in Computational Chemistry","author":"R. Kutteh","year":"1998","unstructured":"R. Kutteh and T. P. Straatsma, Molecular dynamics with general holonomic constraints and application to internal coordinate constraints, in K. B. Lipkowitz and D. B. Boyd, eds., Reviews in Computational Chemistry, Wiley-VCH, New York, 1998, 75\u2013136"},{"key":"108_CR23","doi-asserted-by":"crossref","first-page":"1883","DOI":"10.1021\/j100234a011","volume":"87","author":"G. N\u00e9methy","year":"1983","unstructured":"G. N\u00e9methy, M. S. Pottle and H. A. Scheraga, (ECEPP\/2: empirical conformational energy program for peptides and proteins), Journal of Physical Chemistry, 87 (1983), 1883","journal-title":"Journal of Physical Chemistry"},{"key":"108_CR24","doi-asserted-by":"crossref","first-page":"6472","DOI":"10.1021\/j100194a068","volume":"96","author":"G. N\u00e9methy","year":"1992","unstructured":"G. N\u00e9methy, K. D. Gibson, K. A. Palmer, C. N. Yoon, G. Paterlini, A. Zagari, S. Rumsey and H. A. Scheraga, (ECEPP\/3: empirical conformational energy program for peptides and proteins), Journal of Physical Chemistry, 96 (1992), 6472","journal-title":"Journal of Physical Chemistry"},{"key":"108_CR25","volume-title":"Theory of Unimolecular and Recombination Reactions","author":"R. G. Gilbert","year":"1990","unstructured":"R. G. Gilbert and S. C. Smith, Theory of Unimolecular and Recombination Reactions, Blackwells Scientific, Oxford (1990)"}],"container-title":["Lecture Notes in Computer Science","Computational Science \u2014 ICCS 2003"],"original-title":[],"link":[{"URL":"http:\/\/link.springer.com\/content\/pdf\/10.1007\/3-540-44864-0_108","content-type":"unspecified","content-version":"vor","intended-application":"similarity-checking"}],"deposited":{"date-parts":[[2019,2,17]],"date-time":"2019-02-17T22:10:56Z","timestamp":1550441456000},"score":1,"resource":{"primary":{"URL":"http:\/\/link.springer.com\/10.1007\/3-540-44864-0_108"}},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2003]]},"ISBN":["9783540401971","9783540448648"],"references-count":25,"URL":"https:\/\/doi.org\/10.1007\/3-540-44864-0_108","relation":{},"ISSN":["0302-9743"],"issn-type":[{"type":"print","value":"0302-9743"}],"subject":[],"published":{"date-parts":[[2003]]}}}