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Ab initio molecular orbital calculation of carbohydrate model compounds. 6. The Gauche effect and conformations of the hydroxymethyl and methoxymethyl groups
Title Ab initio molecular orbital calculation of carbohydrate model compounds. 6. The Gauche effect and conformations of the hydroxymethyl and methoxymethyl groups Author Tvaroška Igor 1944 SAVCHEM - Chemický ústav SAV SCOPUS RID ORCID Co-authors Carver J.P. Source document The Journal of Physical Chemistry. Vol. 101, no. (1997), (Neodoberá sa), p. 2992(, p. 2992), p. 2992-2999, B. - Washington : American Chemical Society Language eng - English Document kind rozpis článkov z periodík (rbx) Citations Sen, A (Sen, Anik); Singh, A (Singh, Ajeet); Ganguly, B (Ganguly, Bishwajit) Title: Probing the influence of solvent effects on the conformational behavior of 1,4-diazacyclohexane systems Source: JOURNAL OF MOLECULAR STRUCTURE Volume: 984 Issue: 1-3 Pages: 294-299 DOI: 10.1016/j.molstruc.2010.09.045 Published: DEC 15 2010 Peric-Hassler, L (Peric-Hassler, Lovorka); Hansen, HS (Hansen, Halvor S.); Baron, R (Baron, Riccardo); Hunenberger, PH (Huenenberger, Philippe H.) Title: Conformational properties of glucose-based disaccharides investigated using molecular dynamics simulations with local elevation umbrella sampling Source: CARBOHYDRATE RESEARCH Volume: 345 Issue: 12 Pages: 1781-1801 DOI: 10.1016/j.carres.2010.05.026 Published: AUG 16 2010 Islam, SM (Islam, Shahidul M.); Roy, PN (Roy, Pierre-Nicholas) In: JOURNAL OF CHEMICAL THEORY AND COMPUTATION Volume: 8 Issue: 7 Pages: 2412-2423 Patel, DS (Patel, Dhilon S.); Pendrill, R (Pendrill, Robert); Mallajosyula, SS (Mallajosyula, Sairam S.); Widmalm, G (Widmalm, Goran); MacKerell, AD (MacKerell, Alexander D., Jr.), In: JOURNAL OF PHYSICAL CHEMISTRY B Volume: 118 Issue: 11 Pages: 2851-2871 Category ADC Year 1997 
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rok vydania rok metriky IF IF Q (best) SJR SJR Q (best) 2992
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