Computational Chemistry
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- 2003
-
Mark
Relativistic and correlated calculations on the ground and excited states of ThO.
- Contribution to journal › Article
-
Mark
Metal binding to Bacillus subtilis ferrochelatase and interaction between metal sites.
Lecerof, David LU ; Fodje, Michel LU ; Alvarez León, Román ; Olsson, Ulf LU ; Hansson, Andreas LU ; Sigfridsson, Emma ; Ryde, Ulf LU
; Hansson, Mats
LU
and Al-Karadaghi, Salam
LU
(2003)
In Journal of Biological Inorganic Chemistry
8(4).
p.452-458
- Contribution to journal › Article
-
Mark
The importance of porphyrin distortions for the ferrochelatase reaction.
Sigfridsson, Emma and Ryde, Ulf LU
(2003)
In Journal of Biological Inorganic Chemistry
8(3).
p.273-282
- Contribution to journal › Article
-
Mark
An improved density functional description of hard sphere polymer fluids at low density.
- Contribution to journal › Article
-
Mark
Density functional studies of solvation forces in hard sphere polymer solutions confined between adsorbing walls. I. Solvent effects and dependence on surface potential range.
- Contribution to journal › Article
-
Mark
An accurate quartic force field and fundamental frequencies for the ozonide anion.
- Contribution to journal › Article
-
Mark
Comparison of the chemical properties of iron and cobalt porphyrins and corrins.
- Contribution to journal › Article
-
Mark
A Mesoscopic Model for Protein-Protein Interactions in Solution
- Contribution to journal › Article
-
Mark
The water-hydroxyl radical complex: A matrix isolation study.
- Contribution to journal › Article
-
Mark
Activity coefficients in sea water using monte carlo simulations.
- Contribution to journal › Article