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- 2023
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Mark
A computational study of the reaction mechanism and stereospecificity of dihydropyrimidinase
(
- Contribution to journal › Article
- 2021
-
Mark
On the Use of Interaction Entropy and Related Methods to Estimate Binding Entropies
(
- Contribution to journal › Article
- 2017
-
Mark
Targeting the reactive intermediate in polysaccharide monooxygenases
2017) In Journal of Biological Inorganic Chemistry(
- Contribution to journal › Article
- 2016
-
Mark
Ligand-Binding Affinity Estimates Supported by Quantum-Mechanical Methods
(
- Contribution to journal › Article
- 2014
-
Mark
Computational modelling of oxygenation processes in enzymes and biomimetic model complexes
(
- Contribution to journal › Scientific review
- 2009
-
Mark
Influence of the [2Fe](H) Subcluster Environment on the Properties of Key Intermediates in the Catalytic Cycle of [FeFe] Hydrogenases: Hints for the Rational Design of Synthetic Catalysts
(
- Contribution to journal › Article
- 2008
-
Mark
A Synthetic Analogue of Rieske-Type [2Fe-2S] Clusters
(
- Contribution to journal › Article