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- 2007
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Mark
Coupled cluster calculations of interaction energies in benzene-fluorobenzene van der Waals complexes
(
- Contribution to journal › Article
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Mark
Accuracy of distributed multipoles and polarizabilities: Comparison between the LoProp and MpProp models
(
- Contribution to journal › Article
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Mark
The charge capacity of the chemical bond
(
- Contribution to journal › Article
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Mark
Agostic interaction in the methylidene metal dihydride complexes H2MCH2 (M = Y, Zr, Nb, Mo, Ru, Th, or U)
2007) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 111(28). p.6420-6424(
- Contribution to journal › Article
-
Mark
Calculated reaction cycle of cytochrome c oxidase
(
- Contribution to journal › Article
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Mark
Polyelectrolytes. Physicochemical Aspects and Biological Significance
2007) p.1-39(
- Chapter in Book/Report/Conference proceeding › Book chapter
- 2006
-
Mark
The structures of frataxin oligomers reveal the mechanism for the delivery and detoxification of iron
(
- Contribution to journal › Article
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Mark
Ligand affinities predicted with the MM/PBSA method: Dependence on the simulation method and the force field
(
- Contribution to journal › Article
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Mark
Spin-orbit ab initio investigation of the photolysis of bromoiodomethane
(
- Contribution to journal › Article
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Mark
Driving forces behind ion-ion correlations
(
- Contribution to journal › Article