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- 2006
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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
Multireference ab initio calculations on reaction intermediates of the multicopper oxidases
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- Contribution to journal › Article
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Mark
Prediction of activation energies for hydrogen abstraction by cytochrome P450
(
- Contribution to journal › Article
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Mark
Comparison of overlap-based models for approximating the exchange-repulsion energy
(
- Contribution to journal › Article
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Mark
Implicit versus explicit solvent in free energy calculations of enzyme catalysis: Methyl transfer catalyzed by catechol O-methyltransferase
(
- Contribution to journal › Article
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Mark
Interpretation of EXAFS spectra for sitting-atop complexes with the help of computational methods
(
- Contribution to journal › Article
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Mark
EXAFS structure refinement supplemented by computational chemistry
(
- Contribution to journal › Article
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Mark
The reaction mechanism of iron and manganese superoxide dismutases studied by theoretical calculations
(
- Contribution to journal › Article
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Mark
Structures of the high-valent metal-ion haem-oxygen intermediates in peroxidases, oxygenases and catalases
(
- Contribution to journal › Scientific review