{"status":"ok","message-type":"work","message-version":"1.0.0","message":{"indexed":{"date-parts":[[2026,2,13]],"date-time":"2026-02-13T16:36:33Z","timestamp":1771000593509,"version":"3.50.1"},"reference-count":94,"publisher":"OOO Zhurnal &quot;Mendeleevskie Soobshcheniya&quot;","issue":"3","license":[{"start":{"date-parts":[[2010,5,1]],"date-time":"2010-05-01T00:00:00Z","timestamp":1272672000000},"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":["Mendeleev Communications"],"published-print":{"date-parts":[[2010,5]]},"DOI":"10.1016\/j.mencom.2010.05.001","type":"journal-article","created":{"date-parts":[[2010,6,4]],"date-time":"2010-06-04T08:32:39Z","timestamp":1275640359000},"page":"125-131","source":"Crossref","is-referenced-by-count":165,"title":["Mechanistic insight into organic and catalytic reactions by joint studies using mass spectrometry and NMR spectroscopy"],"prefix":"10.71267","volume":"20","author":[{"given":"Pavel A.","family":"Belyakov","sequence":"first","affiliation":[]},{"given":"Valentine I.","family":"Kadentsev","sequence":"additional","affiliation":[]},{"given":"Alexander O.","family":"Chizhov","sequence":"additional","affiliation":[]},{"given":"Natal\u2019ya G.","family":"Kolotyrkina","sequence":"additional","affiliation":[]},{"given":"Alexander S.","family":"Shashkov","sequence":"additional","affiliation":[]},{"given":"Valentine P.","family":"Ananikov","sequence":"additional","affiliation":[]}],"member":"51372","reference":[{"key":"10.1016\/j.mencom.2010.05.001_bib1_1","doi-asserted-by":"crossref","first-page":"579","DOI":"10.1146\/annurev.anchem.1.031207.112945","volume":"1","author":"Marshall","year":"2008","journal-title":"Ann. Rev. Anal. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib1_2","doi-asserted-by":"crossref","first-page":"227A","DOI":"10.1021\/ac053393z","volume":"77","author":"Cottingham","year":"2005","journal-title":"Anal. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib1_3","doi-asserted-by":"crossref","unstructured":"J. H. Gross, Mass Spectrometry: A Textbook, Springer, Berlin, 2004.","DOI":"10.1007\/3-540-36756-X"},{"key":"10.1016\/j.mencom.2010.05.001_bib1_4","first-page":"36","volume":"23","author":"Bluck","year":"2008","journal-title":"Spectroscopy"},{"key":"10.1016\/j.mencom.2010.05.001_bib2","doi-asserted-by":"crossref","unstructured":"Early days of development: (a) A. L. Burlingame, C. H. L. Shackleton, I. Howe and O. S. Chizhov, Anal. Chem., 1978, 50, 346R; (b) A. L. Burlingame, T. A. Baillie, P. J. Derrick and O. S. Chizhov, Anal. Chem., 1980, 52, 214R; (c) A. A. Solov\u2019ev, V. I. Kadentsev and O. S. Chizhov, Usp. Khim., 1979, 67, 1180 (Russ. Chem. Rev., 1979, 48, 631); (d) O. S. Chizhov, V. I. Kadentsev, G. G. Palmbach, K. I. Burstein, S. A. Shevelev and A. A. Feinsilberg, Org. Mass Spectrom., 1978, 13, 611.","DOI":"10.1021\/ac50028a031"},{"key":"10.1016\/j.mencom.2010.05.001_bib3_1","unstructured":"A. Bax, Two-dimensional NMR in Liquids, Delft University Press, Delft, 1982."},{"key":"10.1016\/j.mencom.2010.05.001_bib3_2","unstructured":"R. R. Ernst, G. Bodenhausen and A.Wokaun, Principles of NMR in One and Two Dimensions, Clarendon Press, Oxford, 1987."},{"key":"10.1016\/j.mencom.2010.05.001_bib3_3","unstructured":"G. E. Martin and A. S. Zektzer, Two-Dimensional NMR Methods for Establishing Molecular Connectivity, Wiley-VCH, 1988."},{"key":"10.1016\/j.mencom.2010.05.001_bib3_4","doi-asserted-by":"crossref","unstructured":"H. Friebolin, Basic One- and Two-Dimensional NMR Spectroscopy, Wiley-VCH, Weinheim, 2005.","DOI":"10.1055\/s-2005-867116"},{"key":"10.1016\/j.mencom.2010.05.001_bib4_1","unstructured":"On-Line LC-NMR and Related Techniques, ed. K. Albert, John Wiley & Sons, Ltd., New York, 2002."},{"key":"10.1016\/j.mencom.2010.05.001_bib4_2","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/j.aca.2003.08.048","volume":"497","author":"Silva Elipe","year":"2003","journal-title":"Anal. Chim. Acta"},{"key":"10.1016\/j.mencom.2010.05.001_bib5_1","doi-asserted-by":"crossref","first-page":"267","DOI":"10.1080\/05704920902717971","volume":"44","author":"Kumar","year":"2009","journal-title":"Appl. Spectrosc. Rev."},{"key":"10.1016\/j.mencom.2010.05.001_bib5_2","doi-asserted-by":"crossref","first-page":"17","DOI":"10.1021\/cr000665j","volume":"104","author":"Seco","year":"2004","journal-title":"Chem. Rev."},{"key":"10.1016\/j.mencom.2010.05.001_bib5_3","doi-asserted-by":"crossref","first-page":"256","DOI":"10.1002\/chir.10190","volume":"15","author":"Wenzel","year":"2003","journal-title":"Chirality"},{"key":"10.1016\/j.mencom.2010.05.001_bib5_4","first-page":"457","volume":"5","author":"Rothchild","year":"2000","journal-title":"Enantiomer"},{"key":"10.1016\/j.mencom.2010.05.001_bib5_5","doi-asserted-by":"crossref","first-page":"3212","DOI":"10.1039\/b923359h","volume":"46","author":"Orlov","year":"2010","journal-title":"Chem. Commun."},{"key":"10.1016\/j.mencom.2010.05.001_bib6","first-page":"740","author":"Ananikov","year":"2008","journal-title":"Izv. Akad. Nauk, Ser. Khim."},{"key":"10.1016\/j.mencom.2010.05.001_bib7","doi-asserted-by":"crossref","first-page":"95","DOI":"10.1016\/j.pnmrs.2005.08.002","volume":"47","author":"Yonker","year":"2005","journal-title":"Prog. Nucl. Magn. Reson. Spectrosc."},{"key":"10.1016\/j.mencom.2010.05.001_bib8_1","doi-asserted-by":"crossref","first-page":"311","DOI":"10.1016\/j.pbiomolbio.2004.07.009","volume":"88","author":"Stock","year":"2005","journal-title":"Prog. Biophys. Mol. Biol."},{"key":"10.1016\/j.mencom.2010.05.001_bib8_2","doi-asserted-by":"crossref","first-page":"329","DOI":"10.1016\/j.pbiomolbio.2004.07.007","volume":"88","author":"Chayen","year":"2005","journal-title":"Prog. Biophys. Mol. Biol."},{"key":"10.1016\/j.mencom.2010.05.001_bib9_1","doi-asserted-by":"crossref","first-page":"19","DOI":"10.1255\/ejms.837","volume":"13","author":"Eberlin","year":"2007","journal-title":"Eur. J. Mass Spectrom."},{"key":"10.1016\/j.mencom.2010.05.001_bib9_2","doi-asserted-by":"crossref","first-page":"235","DOI":"10.1002\/ejoc.200700723","author":"Santos","year":"2008","journal-title":"Eur. J. Org. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib9_3","doi-asserted-by":"crossref","first-page":"347","DOI":"10.1002\/mas.20070","volume":"25","author":"Di Marco","year":"2006","journal-title":"Mass Spectrom. Rev."},{"key":"10.1016\/j.mencom.2010.05.001_bib9_4","doi-asserted-by":"crossref","first-page":"898","DOI":"10.1002\/mas.20247","volume":"28","author":"Kebarle","year":"2009","journal-title":"Mass Spectrom. Rev."},{"key":"10.1016\/j.mencom.2010.05.001_bib10","doi-asserted-by":"crossref","unstructured":"Examples from our group: (a) V. I. Kadentsev, A. O. Chizhov, O. S. Chizhov, O. N. Krupinova, V. M. Rzheznikov and L. E. Golubovskaya, Eur. J. Mass. Spectrom., 2006, 12, 75; (b) V. I. Kadentsev, A. O. Chizhov, O. S. Chizhov, N. G. Kolotyrkina, A. A. Kutin, I. D. Nesterov, N. D. Chuvylkin, V. M. Rzheznikov and L. E. Golubovskaya, Eur. J. Mass. Spectrom., 2007, 13, 207; (c) V. I. Kadentsev, A. O. Chizhov, O. S. Chizhov, N. G. Kolotyrkina, A. A. Kutin, V. M. Rzheznikov and L. E. Golubovskaya, Izv. Akad. Nauk, Ser. Khim., 2008, 92.(Russ. Chem. Bull., Int. Ed., 2008, 57, 95).","DOI":"10.1255\/ejms.787"},{"key":"10.1016\/j.mencom.2010.05.001_bib11","doi-asserted-by":"crossref","first-page":"131","DOI":"10.1016\/j.pnmrs.2005.03.001","volume":"46","author":"Kovacs","year":"2005","journal-title":"Prog. Nucl. Magn. Reson. Spectrosc."},{"key":"10.1016\/j.mencom.2010.05.001_bib12_1","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/S0066-4103(05)56001-0","volume":"56","author":"Martin","year":"2005","journal-title":"Ann. Rep. NMR Spectrosc."},{"key":"10.1016\/j.mencom.2010.05.001_bib12_2","doi-asserted-by":"crossref","first-page":"155","DOI":"10.1016\/S0066-4103(05)58003-7","volume":"58","author":"Fujiwara","year":"2006","journal-title":"Ann. Rep. NMR Spectrosc."},{"key":"10.1016\/j.mencom.2010.05.001_bib13","doi-asserted-by":"crossref","first-page":"2671","DOI":"10.1002\/ejoc.200700966","author":"Kwan","year":"2008","journal-title":"Eur. J. Org. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib14_1","doi-asserted-by":"crossref","first-page":"9198","DOI":"10.1073\/pnas.0703001104","volume":"104","author":"Maguire","year":"2007","journal-title":"Proc. Natl. Acad. Sci. USA"},{"key":"10.1016\/j.mencom.2010.05.001_bib14_2","doi-asserted-by":"crossref","first-page":"052202","DOI":"10.1063\/1.2833560","volume":"128","author":"Kentgens","year":"2008","journal-title":"J. Chem. Phys."},{"key":"10.1016\/j.mencom.2010.05.001_bib14_3","doi-asserted-by":"crossref","first-page":"1967","DOI":"10.1126\/science.270.5244.1967","volume":"270","author":"Olson","year":"1995","journal-title":"Science"},{"key":"10.1016\/j.mencom.2010.05.001_bib15_1","first-page":"471","volume":"28","author":"Bodenhausen","year":"1977","journal-title":"J. Magn. Reson."},{"key":"10.1016\/j.mencom.2010.05.001_bib15_2","doi-asserted-by":"crossref","first-page":"368","DOI":"10.1016\/0009-2614(77)80345-X","volume":"50","author":"Maudsley","year":"1977","journal-title":"Chem. Phys. Lett."},{"key":"10.1016\/j.mencom.2010.05.001_bib15_3","doi-asserted-by":"crossref","first-page":"185","DOI":"10.1016\/0009-2614(80)80041-8","volume":"69","author":"Bodenhausen","year":"1980","journal-title":"Chem. Phys. Lett."},{"key":"10.1016\/j.mencom.2010.05.001_bib15_4","first-page":"301","volume":"55","author":"Bax","year":"1983","journal-title":"J. Magn. Reson."},{"key":"10.1016\/j.mencom.2010.05.001_bib16","doi-asserted-by":"crossref","first-page":"4861","DOI":"10.1002\/chem.200702002","volume":"14","author":"Skonieczny","year":"2008","journal-title":"Chem. Eur. J."},{"key":"10.1016\/j.mencom.2010.05.001_bib17_1","doi-asserted-by":"crossref","first-page":"4785","DOI":"10.1021\/ic800045u","volume":"47","author":"Gallo","year":"2008","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib17_2","doi-asserted-by":"crossref","first-page":"6005","DOI":"10.1039\/b808966c","author":"Dell\u2019Anna","year":"2008","journal-title":"Dalton Trans."},{"key":"10.1016\/j.mencom.2010.05.001_bib18","doi-asserted-by":"crossref","first-page":"411","DOI":"10.1016\/S1387-7003(98)00102-6","volume":"1","author":"Ananikov","year":"1998","journal-title":"Inorg. Chem. Commun."},{"key":"10.1016\/j.mencom.2010.05.001_bib19","first-page":"672","volume":"38","author":"Ananikov","year":"2002","journal-title":"Zh. Org. Khim."},{"key":"10.1016\/j.mencom.2010.05.001_bib20","first-page":"343","volume":"363","author":"Ananikov","year":"1998","journal-title":"Dokl. Akad. Nauk"},{"key":"10.1016\/j.mencom.2010.05.001_bib21","unstructured":"Selected recent examples: (a) V. P. Ananikov, D. A. Malyshev, I. P. Beletskaya, G. G. Aleksandrov and I. L. Eremenko, Adv. Synth. Catal., 2005, 347, 1993; (b) P. Ribi\u00e8re, K. Bravo-Altamirano, M. I. Antczak, J. D. Hawkins and J.-L.Montchamp, J. Org. Chem., 2005, 70, 4064; (c) M. M. Heravi, K. Bakhtiari, H. A. Oskooie and S. Taheri, J. Mol. Cat. A-Chem., 2007, 263, 279; (d) G. Liu, Q. L. Du, J. J. Xie, K. L. Zhang and X. C. Tao, Chin. J. Catal., 2006, 27, 1051; (e) D. Zim and A. L. Monteiro, Tetrahedron Lett., 2002, 43, 2009."},{"key":"10.1016\/j.mencom.2010.05.001_bib22","doi-asserted-by":"crossref","first-page":"486","DOI":"10.1002\/bip.20885","volume":"89","author":"Ruff","year":"2007","journal-title":"Biopolymers"},{"key":"10.1016\/j.mencom.2010.05.001_bib23","doi-asserted-by":"crossref","first-page":"1048","DOI":"10.1039\/b713367g","volume":"32","author":"Champin","year":"2008","journal-title":"New J. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib24","doi-asserted-by":"crossref","first-page":"1430","DOI":"10.1021\/ja056465c","volume":"128","author":"Schmuck","year":"2006","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.mencom.2010.05.001_bib25","doi-asserted-by":"crossref","first-page":"3930","DOI":"10.1002\/ejoc.200900338","author":"Chmielewski","year":"2009","journal-title":"Eur. J. Org. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib26_1","doi-asserted-by":"crossref","first-page":"2950","DOI":"10.1021\/ja8002149","volume":"130","author":"Westcott","year":"2008","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.mencom.2010.05.001_bib26_2","doi-asserted-by":"crossref","first-page":"13661","DOI":"10.1021\/ja074435z","volume":"129","author":"Maeda","year":"2007","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.mencom.2010.05.001_bib26_3","doi-asserted-by":"crossref","first-page":"1862","DOI":"10.1021\/ic701584e","volume":"47","author":"Gasnier","year":"2008","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib26_4","doi-asserted-by":"crossref","first-page":"675","DOI":"10.1021\/ol062824c","volume":"9","author":"Chas","year":"2007","journal-title":"Org. Lett."},{"key":"10.1016\/j.mencom.2010.05.001_bib27","unstructured":"D. Neuhaus and M. P. Williamson, The Nuclear Overhauser Effect in Structural and Conformational Analysis, Wiley-VCH, Weinheim, 2000."},{"key":"10.1016\/j.mencom.2010.05.001_bib28","doi-asserted-by":"crossref","first-page":"159","DOI":"10.1016\/j.pnmrs.2005.04.003","volume":"46","author":"Brand","year":"2005","journal-title":"Prog. Nucl. Magn. Reson. Spectrosc."},{"key":"10.1016\/j.mencom.2010.05.001_bib29","doi-asserted-by":"crossref","first-page":"3691","DOI":"10.1002\/chem.200802391","volume":"15","author":"Lohr","year":"2009","journal-title":"Chem. Eur. J."},{"key":"10.1016\/j.mencom.2010.05.001_bib30_1","doi-asserted-by":"crossref","first-page":"309","DOI":"10.1002\/mnfr.200400092","volume":"49","author":"Bretz","year":"2005","journal-title":"Mol. Nutr. Food Res."},{"key":"10.1016\/j.mencom.2010.05.001_bib30_2","doi-asserted-by":"crossref","first-page":"2320","DOI":"10.1002\/anie.200604076","volume":"46","author":"Grube","year":"2007","journal-title":"Angew. Chem. Int. Ed."},{"key":"10.1016\/j.mencom.2010.05.001_bib30_3","doi-asserted-by":"crossref","first-page":"2692","DOI":"10.1002\/cbic.200800415","volume":"9","author":"Mehner","year":"2008","journal-title":"ChemBioChem"},{"key":"10.1016\/j.mencom.2010.05.001_bib30_4","doi-asserted-by":"crossref","first-page":"772","DOI":"10.1021\/np070508g","volume":"71","author":"Rao","year":"2008","journal-title":"J. Nat. Prod."},{"key":"10.1016\/j.mencom.2010.05.001_bib30_5","doi-asserted-by":"crossref","first-page":"4247","DOI":"10.1021\/ol8016512","volume":"10","author":"El-Naggar","year":"2008","journal-title":"Org. Lett."},{"key":"10.1016\/j.mencom.2010.05.001_bib31_1","doi-asserted-by":"crossref","first-page":"432","DOI":"10.1021\/ic800591n","volume":"48","author":"Chmielewski","year":"2009","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib31_2","doi-asserted-by":"crossref","first-page":"10520","DOI":"10.1021\/ic700734q","volume":"46","author":"Bonnet","year":"2007","journal-title":"Inorg. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib31_3","doi-asserted-by":"crossref","first-page":"3484","DOI":"10.1021\/om070164p","volume":"26","author":"Reade","year":"2007","journal-title":"Organometallics"},{"key":"10.1016\/j.mencom.2010.05.001_bib32","doi-asserted-by":"crossref","first-page":"5632","DOI":"10.1002\/chem.200600143","volume":"12","author":"Marquis","year":"2006","journal-title":"Chem. Eur. J."},{"key":"10.1016\/j.mencom.2010.05.001_bib33_1","doi-asserted-by":"crossref","first-page":"658","DOI":"10.1016\/j.orggeochem.2008.02.020","volume":"39","author":"M\u00e9tayer","year":"2008","journal-title":"Org. Geochem."},{"key":"10.1016\/j.mencom.2010.05.001_bib33_2","doi-asserted-by":"crossref","first-page":"710","DOI":"10.1002\/mrc.1633","volume":"43","author":"Pham","year":"2005","journal-title":"Magn. Reson. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib34_1","doi-asserted-by":"crossref","first-page":"735","DOI":"10.1002\/mrc.1260260904","volume":"26","author":"Shashkov","year":"1988","journal-title":"Magn. Reson. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib34_2","doi-asserted-by":"crossref","first-page":"175","DOI":"10.1016\/S0008-6215(00)90628-1","volume":"147","author":"Shashkov","year":"1986","journal-title":"Carbohydr. Res."},{"key":"10.1016\/j.mencom.2010.05.001_bib34_3","doi-asserted-by":"crossref","first-page":"1","DOI":"10.1016\/0008-6215(88)84018-7","volume":"181","author":"Lipkind","year":"1988","journal-title":"Carbohydr. Res."},{"key":"10.1016\/j.mencom.2010.05.001_bib34_4","doi-asserted-by":"crossref","first-page":"173","DOI":"10.1016\/0008-6215(84)85196-4","volume":"133","author":"Kochetkov","year":"1984","journal-title":"Carbohydr. Res."},{"key":"10.1016\/j.mencom.2010.05.001_bib35_1","doi-asserted-by":"crossref","first-page":"5587","DOI":"10.1016\/0040-4020(68)88156-6","volume":"24","author":"Kochetkov","year":"1968","journal-title":"Tetrahedron"},{"key":"10.1016\/j.mencom.2010.05.001_bib35_2","doi-asserted-by":"crossref","first-page":"277","DOI":"10.1016\/S0008-6215(00)80000-2","volume":"14","author":"Kochetkov","year":"1970","journal-title":"Carbohydr. Res."},{"key":"10.1016\/j.mencom.2010.05.001_bib35_3","doi-asserted-by":"crossref","first-page":"37","DOI":"10.1016\/S0008-6215(00)85723-7","volume":"22","author":"Chizhov","year":"1972","journal-title":"Carbohydr. Res."},{"key":"10.1016\/j.mencom.2010.05.001_bib36","doi-asserted-by":"crossref","unstructured":"Selected recent examples: (a) N. A. Kocharova, A. N. Kondakova, E. Vinogradov, O. G. Ovchinnikova, B. Lindner, A. S. Shashkov, A. Rozalski and Y. A. Knirel, Chem. Eur. J., 2008, 14, 6184; (b) A. N. Kondakova, N. Ho, O. V. Bystrova, A. S. Shashkov, B. Lindner, C. Creuzenet and Y. A. Knirel, Carbohydr. Res., 2008, 343, 1383; (c) A. V. Perepelov, B. Liu, S. D. Shevelev, S. N. Senchenkova, A. S. Shashkov, L. Feng, Y. A. Knirel and L.Wang, Carbohydr. Res., 2010, 345, 825; (d) A. N. Kondakova, B. Linder, R. Fudala, S. N. Senchenkova, H. Moll, A. S. Shashkov, W. Kaca, U. Z\u00e4hringer and Y. A. Knirel, Biokhimiya, 2004, 69, 1271. [Biochemistry (Moscow), 2004, 69, 1034].","DOI":"10.1002\/chem.200702039"},{"key":"10.1016\/j.mencom.2010.05.001_bib37","doi-asserted-by":"crossref","first-page":"977","DOI":"10.1002\/anie.200503307","volume":"45","author":"Santos","year":"2006","journal-title":"Angew. Chem. Int. Ed."},{"key":"10.1016\/j.mencom.2010.05.001_bib38_1","doi-asserted-by":"crossref","first-page":"5335","DOI":"10.1021\/ac990876s","volume":"71","author":"Subramanian","year":"1999","journal-title":"Anal. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib38_2","doi-asserted-by":"crossref","first-page":"8109","DOI":"10.1021\/ac051320+","volume":"77","author":"McDonnell","year":"2005","journal-title":"Anal. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib38_3","doi-asserted-by":"crossref","first-page":"280","DOI":"10.1039\/b414832k","volume":"5","author":"Wensink","year":"2005","journal-title":"Lab Chip"},{"key":"10.1016\/j.mencom.2010.05.001_bib39","doi-asserted-by":"crossref","first-page":"90","DOI":"10.1039\/B510708C","volume":"6","author":"Ahola","year":"2006","journal-title":"Lab Chip"},{"key":"10.1016\/j.mencom.2010.05.001_bib40_1","doi-asserted-by":"crossref","first-page":"385","DOI":"10.1016\/S0920-5861(01)00396-0","volume":"69","author":"Koptyug","year":"2001","journal-title":"Catalysis Today"},{"key":"10.1016\/j.mencom.2010.05.001_bib40_2","doi-asserted-by":"crossref","first-page":"628","DOI":"10.1070\/RC2007v076n06ABEH003708","volume":"76","author":"Koptyug","year":"2007","journal-title":"Usp. Khim."},{"key":"10.1016\/j.mencom.2010.05.001_bib40_3","doi-asserted-by":"crossref","first-page":"126","DOI":"10.1016\/j.apcata.2009.11.038","volume":"374","author":"Lysova","year":"2010","journal-title":"Appl. Cat. A \u2013 Gen."},{"key":"10.1016\/j.mencom.2010.05.001_bib41_1","doi-asserted-by":"crossref","unstructured":"W. Koch and M. C. Holthausen, A Chemist's Guide to Density Functional Theory, Wiley-VCH, Weinheim, 2002.","DOI":"10.1002\/3527600043"},{"key":"10.1016\/j.mencom.2010.05.001_bib41_2","doi-asserted-by":"crossref","unstructured":"Computational Modeling for Homogeneous and Enzymatic Catalysis: A Knowledge-Base for Designing Efficient Catalysts, eds. K. Morokuma and D. G. Musaev, Wiley-VCH, Weinheim, 2008.","DOI":"10.1016\/S1351-4180(08)70483-5"},{"key":"10.1016\/j.mencom.2010.05.001_bib41_3","unstructured":"Modelling NMR Chemical Shifts, eds. J. C. Facelli and A. C. de Dios, ACS Symposium series 732, American Chemical Society, Washington, DC, 1999."},{"key":"10.1016\/j.mencom.2010.05.001_bib42_1","doi-asserted-by":"crossref","first-page":"35","DOI":"10.1016\/S1574-1400(06)02003-2","volume":"2","author":"Vreven","year":"2006","journal-title":"Ann. Rep. Comput. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib42_2","doi-asserted-by":"crossref","first-page":"2247","DOI":"10.1246\/bcsj.80.2247","volume":"80","author":"Morokuma","year":"2007","journal-title":"Bull. Chem. Soc. Jpn."},{"key":"10.1016\/j.mencom.2010.05.001_bib42_3","doi-asserted-by":"crossref","first-page":"5390","DOI":"10.1002\/ejic.200700850","author":"Ananikov","year":"2007","journal-title":"Eur. J. Inorg. Chem."},{"key":"10.1016\/j.mencom.2010.05.001_bib43","doi-asserted-by":"crossref","first-page":"5005","DOI":"10.1021\/ja971134o","volume":"120","author":"Khabashesku","year":"1998","journal-title":"J. Am. Chem. Soc."},{"key":"10.1016\/j.mencom.2010.05.001_bib44","doi-asserted-by":"crossref","unstructured":"Representative examples: (a) X.-Y. Yu, X. Xu and Z. Chen, Int. J. Mass Spectrom., 2008, 269, 138; (b) J. C. Choe, Int. J. Mass Spectrom., 2008, 278, 50; (c) P. Skurski, J. Simons, X.-B. Wang and L.-S. Wang, J. Am. Chem. Soc., 2000, 122, 4499; (d) M. J. Rusyniak, Y. M. Ibrahim, D. L. Wright, S. N. Khanna and M. S. El-Shall, J. Am. Chem. Soc., 2003, 125, 12001; (e) Y. Guo, S. Cao, D. Wei, X. Zong, X. Yuan, M. Tang and Y. Zhao, J. Mass. Spectrom., 2009, 44, 1188; (f) B. Amekraz, J. Tortajada, J.-P. Morizur, A. I. Gonz\u00e1lez, O. M\u00f3, M. Y\u00e1\u00f1ez, I. Leito, P.-C. Maria and J.-F. Gal, New J. Chem., 1996, 20, 1011; (g) N. D. Chuvylkin, I. D. Nesterov and V. I. Kadentsev, Izv. Akad. Nauk, Ser. Khim., 2008, 246.(Russ. Chem. Bull., Int. Ed., 2008, 57, 253).","DOI":"10.1016\/j.ijms.2007.09.022"},{"key":"10.1016\/j.mencom.2010.05.001_bib45","doi-asserted-by":"crossref","first-page":"195","DOI":"10.1002\/mas.10005","volume":"20","author":"Alcam\u00ed","year":"2001","journal-title":"Mass Spectrom. Rev."},{"key":"10.1016\/j.mencom.2010.05.001_bib46","doi-asserted-by":"crossref","first-page":"12460","DOI":"10.1002\/chem.200900966","volume":"15","author":"Amarante","year":"2009","journal-title":"Chem. Eur. J."},{"key":"10.1016\/j.mencom.2010.05.001_bib47_1","doi-asserted-by":"crossref","first-page":"222","DOI":"10.1021\/ct700268q","volume":"4","author":"Ufimtsev","year":"2008","journal-title":"J. Chem. Theory Comput."},{"key":"10.1016\/j.mencom.2010.05.001_bib47_2","doi-asserted-by":"crossref","first-page":"1004","DOI":"10.1021\/ct800526s","volume":"5","author":"Ufimtsev","year":"2009","journal-title":"J. Chem. Theory Comput."},{"key":"10.1016\/j.mencom.2010.05.001_bib47_3","doi-asserted-by":"crossref","first-page":"2619","DOI":"10.1021\/ct9003004","volume":"5","author":"Ufimtsev","year":"2009","journal-title":"J. Chem. Theory Comput."}],"container-title":["Mendeleev Communications"],"original-title":[],"language":"en","link":[{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0959943610000672?httpAccept=text\/xml","content-type":"text\/xml","content-version":"vor","intended-application":"text-mining"},{"URL":"https:\/\/api.elsevier.com\/content\/article\/PII:S0959943610000672?httpAccept=text\/plain","content-type":"text\/plain","content-version":"vor","intended-application":"text-mining"}],"deposited":{"date-parts":[[2025,6,8]],"date-time":"2025-06-08T20:13:02Z","timestamp":1749413582000},"score":1,"resource":{"primary":{"URL":"https:\/\/linkinghub.elsevier.com\/retrieve\/pii\/S0959943610000672"},"secondary":[{"URL":"https:\/\/www.mathnet.ru\/eng\/mendc3012","label":"SECONDARY"}]},"subtitle":[],"short-title":[],"issued":{"date-parts":[[2010,5]]},"references-count":94,"journal-issue":{"issue":"3","published-print":{"date-parts":[[2010,5]]}},"alternative-id":["S0959943610000672"],"URL":"https:\/\/doi.org\/10.1016\/j.mencom.2010.05.001","relation":{},"ISSN":["0959-9436"],"issn-type":[{"value":"0959-9436","type":"print"}],"subject":[],"published":{"date-parts":[[2010,5]]}}}