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Results: 1-8 |
Results: 8
The design of combinatorial libraries using properties and 3D pharmacophore fingerprints
Authors: Beno, BR Mason, JS
Citation: Br. Beno et Js. Mason, The design of combinatorial libraries using properties and 3D pharmacophore fingerprints, DRUG DISC T, 6(5), 2001, pp. 251-258
Transition structures and exo/endo stereoselectivities of concerted [6+4] cycloadditions with density functional theory
Authors: Goldstein, E Beno, BR Houk, KN
Citation: E. Goldstein et al., Transition structures and exo/endo stereoselectivities of concerted [6+4] cycloadditions with density functional theory, THEOR CH AC, 103(1), 1999, pp. 81-84
Pressure-induced cycloadditions of dicyanoacetylene to strained arenes: The formation of cyclooctatetraene, 9,10-dihydronaphthalene, and azulene derivatives; A degenerate [1,5] sigmatropic shift - Comparison between theory and experiment
Authors: Klarner, FG Ehrhardt, R Bandmann, H Boese, R Blaser, D Houk, KN Beno, BR
Citation: Fg. Klarner et al., Pressure-induced cycloadditions of dicyanoacetylene to strained arenes: The formation of cyclooctatetraene, 9,10-dihydronaphthalene, and azulene derivatives; A degenerate [1,5] sigmatropic shift - Comparison between theory and experiment, CHEM-EUR J, 5(7), 1999, pp. 2119-2132
Isotope effects for Lewis acid catalyzed Diels-Alder reactions. The experimental transition state
Authors: Singleton, DA Merrigan, SR Beno, BR Houk, KN
Citation: Da. Singleton et al., Isotope effects for Lewis acid catalyzed Diels-Alder reactions. The experimental transition state, TETRAHEDR L, 40(32), 1999, pp. 5817-5821
A Becke3LYP/6-31Gstudy of the cope rearrangements of substituted 1,5-hexadienes provides computational evidence for a chameleonic transition state
Authors: Hrovat, DA Beno, BR Lange, H Yoo, HY Houk, KN Borden, WT
Citation: Da. Hrovat et al., A Becke3LYP/6-31Gstudy of the cope rearrangements of substituted 1,5-hexadienes provides computational evidence for a chameleonic transition state, J AM CHEM S, 121(45), 1999, pp. 10529-10537
The C7H10 potential energy landscape: Concerted transition states and diradical intermediates for the retro-Diels-Alder reaction and [1,3] sigmatropic shifts of norbornene
Authors: Beno, BR Wilsey, S Houk, KN
Citation: Br. Beno et al., The C7H10 potential energy landscape: Concerted transition states and diradical intermediates for the retro-Diels-Alder reaction and [1,3] sigmatropic shifts of norbornene, J AM CHEM S, 121(20), 1999, pp. 4816-4826
Unexpected complexity in the thermal [(pi)2+(sigma)2+(sigma)2] cycloaddition reactions of quadricyclane: Theory and isotope effects
Authors: Jones, GA Shephard, MJ Paddon-Row, MN Beno, BR Houk, KN Redmond, K Carpenter, BK
Citation: Ga. Jones et al., Unexpected complexity in the thermal [(pi)2+(sigma)2+(sigma)2] cycloaddition reactions of quadricyclane: Theory and isotope effects, J AM CHEM S, 121(18), 1999, pp. 4334-4339
Retro-cycloadditions and sigmatropic shifts: The C7H8 and C7H10 potential energy surfaces
Authors: Houk, KN Wilsey, SL Beno, BR Kless, A Nendel, M Tian, J
Citation: Kn. Houk et al., Retro-cycloadditions and sigmatropic shifts: The C7H8 and C7H10 potential energy surfaces, PUR A CHEM, 70(10), 1998, pp. 1947-1952
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