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Journal of Molecular Structure

Judson R S, E P Jaeger and A M Treasurywala 1994. A Genetic Algorithm-Based Method for Dockin Flexible Molecules. Journal of Molecular Structure Theochem 114 191-206. [Pg.739]

One issue of the Journal of Molecular Structure each year contains a tabulation referencing all theoretical computations published the previous year. More recent years of this compilation are available online at http //qcldb.ims.ac.jp/... [Pg.142]

Bravo-Perez, G., Garzon, I.L. and Novaro, O. (1999) Ab initio study of small gold clusters. Journal of Molecular Structure THEOCHEM, 493, 225-231. [Pg.222]

Robinson, E.A., Johnson, S.A., Tang, T.-H., Gillespie, R.J. (1997). Reinterpretation of the lengths of bonds to fluorine in terms of an almost ionic model. Inorganic Chemistry, 36, 3022-3030. Schinder, H.L. Becke, A.D. (2000). Chemical contents of the kinetic energy density. Journal of Molecular Structure (THEOCHEM), 527, 51-61. [Pg.298]

Kopsel C, Moltgen H, Schuch H, Auweter H, Kleinermanns K, Martin HD, and Bettermann H. 2005. Structure investigations on assembled astaxanthin molecules. Journal of Molecular Structure 750 109-115. [Pg.56]

Kwiatkowski, J. S., and J. Leszczynski. 1996. 2( 1 H)-Pyridone system and its thio and seleno analogs—Density Functional Theory Versus Conventional ab initio Calculations. Journal of Molecular Structure 367, 325. [Pg.124]

Peptide and protein folding. Journal of Molecular Structure Theochem 537, 319-361. [Pg.35]

De Benedetti, P.G., Menziani, M.C., Cocchi, M. and Fanelli, F. (1995) Prototropic molecular forms and theoretical descriptors in QSAR analysis. Journal of Molecular Structure (Theochemj, 333, 1—17. [Pg.187]

M., Fanelli, F. and De Benedetti, P.G. (1992) Molecular modeling and quantitative structure-activity relationship analysis using theoretical descriptors of 1,4-benzodioxan (WB-4101) related compounds al-adrenergic antagonists. Journal of Molecular Structure (Theochem), 276, 327-340. [Pg.189]

F. Ramondo, N. Sauna and L. Bencivermi, Journal of Molecular Structure (Theochem), 1992,258, 361. [Pg.359]

Wiewiorowski, M., Pieczonka, G. and Skolik, J. 1977. Futher smdies on the stereochemistry of sparteine, its isomers and derivatives. Part 1. Synthesis, structure and properties of 16,17-endo-methylene-lupaninium perchlorate, 17 3-methyllupanine and 17(3-methyl sparteine. Journal of Molecular Structure, 40 233. [Pg.253]

Borowiak, T., Kubicki, M., Wysocka, W. and Przybyl, A. 1998. Regioselective bromination of multiflorine and structures of 3-bromomultiflorine and its molecular complex with succinimide. Journal of Molecular Structure, 442 103-113. [Pg.284]

Testa, B. (2000) Molecular fields in quantitative structure permeation relationships the VolSurf approach. Journal of Molecular Structure, 503,17-30. [Pg.116]

Alves De Lima Ribeiros, F. and Castro Ferreira, M. (2005) QSAR model of the phototoxicity of polycyclic aromatic hydrocarbons. Journal of Molecular Structure, 719, 191—200. [Pg.490]

I.Balint, G.Dezso, I.Gyemant, Journal of Molecular Structure, THEOCHEM 501-502 125-132 (2000)... [Pg.157]

See other pages where Journal of Molecular Structure is mentioned: [Pg.127]    [Pg.90]    [Pg.230]    [Pg.318]    [Pg.1608]    [Pg.386]    [Pg.39]    [Pg.241]    [Pg.236]    [Pg.605]    [Pg.340]    [Pg.204]    [Pg.208]    [Pg.208]    [Pg.504]    [Pg.268]    [Pg.208]    [Pg.431]    [Pg.376]    [Pg.399]    [Pg.1242]   
See also in sourсe #XX -- [ Pg.403 ]

See also in sourсe #XX -- [ Pg.470 , Pg.474 ]



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