화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 CASSCF Molecular Orbital Calculations Reveal a Purely Pseudopericyclic Mechanism for a [3,3] Sigmatropic Rearrangement
Forte L, Lafortune MC, Bierzynski IR, Duncan JA
Journal of the American Chemical Society, 132(7), 2196, 2010
2 How the Noninflammasome NLRs Function in the Innate Immune System
Ting JPY, Duncan JA, Lei Y
Science, 327(5963), 286, 2010
3 MOLCAS 7.2.
Duncan JA
Journal of the American Chemical Society, 131(6), 2416, 2009
4 Secondary orbital effect in the electrocyclic ring closure of 7-azahepta-1,2,4,6-tetraene - A CASSCF molecular orbital study
Duncan JA, Calkins DEG, Chavarha M
Journal of the American Chemical Society, 130(21), 6740, 2008
5 Ab initio and DFT calculations on the Cope rearrangement of 1,2,6-heptatriene
Hrovat DA, Duncan JA, Borden WT
Journal of the American Chemical Society, 121(1), 169, 1999
6 Ab initio computational study of the allenyl cope rearrangement of syn-7-allenylnorbornene
Duncan JA, Azar JK, Beathe JC, Kennedy SR, Wulf CM
Journal of the American Chemical Society, 121(51), 12029, 1999