검색결과 : 4건
| No. | Article |
|---|---|
| 1 |
Proton distribution in one-electron reduced thioredoxin modulated by aspartate 30: A QM/MM study Berges J, Rickard GA, Rauk A, Houee-Levin C Chemical Physics Letters, 454(1-3), 118, 2008 |
| 2 |
Ab initio and QM/MM study of electron addition on the disulfide bond in thioredoxin Rickard GA, Berges J, Houee-Levin C, Rauk A Journal of Physical Chemistry B, 112(18), 5774, 2008 |
| 3 |
Binding affinities for models of biologically available potential Cu(II) Ligands relevant to Alzheimer's disease: An ab initio study Rickard GA, Gomez-Balderas R, Brunelle P, Raffa DF, Rauk A Journal of Physical Chemistry A, 109(37), 8361, 2005 |
| 4 |
Calculation of NMR chemical shifts in carbohydrates with ONIOM: A study of the conformers of beta-D-glucopyranose Rickard GA, Karadakov PB, Webb GA, Morokuma K Journal of Physical Chemistry A, 107(2), 292, 2003 |