191 – 200 of 309
- show: 10
- |
- sort: year (new to old)
Close
Embed this list
<iframe src=" "
width=" "
height=" "
allowtransparency="true"
frameborder="0">
</iframe>
- 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
-
Mark
An improved method to predict the entropy term with the MM/PBSA approach.
(
- Contribution to journal › Article
-
Mark
Quantum mechanical/molecular mechanical (QM/MM) methods and applications in bioinorganic chemistry
2009) p.33-42(
- Chapter in Book/Report/Conference proceeding › Book chapter
-
Mark
Rubus sect. Corylifolii in the province of Halland, SW Sweden
(
- Contribution to journal › Article
-
Mark
Which functional groups of the molybdopterin ligand should be considered when modeling the active sites of the molybdenum and tungsten cofactors? A density functional theory study.
(
- Contribution to journal › Article
- 2008
-
Mark
Proton transfer at metal sites in proteins studied by quantum mechanical free-energy perturbations
(
- Contribution to journal › Article
-
Mark
QM/MM-PBSA method to estimate free energies for reactions in proteins
(
- Contribution to journal › Article
-
Mark
Prediction of Activation Energies for Aromatic Oxidation by Cytochrome P450
2008) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 112(50). p.13058-13065(
- Contribution to journal › Article
-
Mark
A Synthetic Analogue of Rieske-Type [2Fe-2S] Clusters
(
- Contribution to journal › Article
-
Mark
Effect of covalent links on the structure, spectra, and redox properties of myeloperoxidase - A density functional study.
(
- Contribution to journal › Article