Computational Chemistry
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- 2008
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Mark
A comparison of the tetrapyrrole cofactors in nature and their tuning by axial ligands
2008) p.27-56(
- Chapter in Book/Report/Conference proceeding › Book chapter
- 2007
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Mark
Interactions between charged surfaces immersed in a polyelectrolyte solution
(
- Contribution to journal › Article
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Mark
Multiconfigurational quantum chemical methods for molecular systems containing actinides
(
- Contribution to journal › Scientific review
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Mark
The role of axial ligands for the structure and function of chlorophylls
(
- Contribution to journal › Article
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Mark
Experimental and theoretical evidence of overcharging of calcium silicate hydrate
(
- Contribution to journal › Article
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Mark
Simulations and density functional calculations of surface forces in the presence of semiflexible polymers
(
- Contribution to journal › Article
-
Mark
Implications of a high dielectric constant in proteins
(
- Contribution to journal › Article
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Mark
General transition-state force field for cytochrome p450 Hydroxylation
(
- Contribution to journal › Article
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Mark
Performance of density functionals for first row transition metal systems
(
- Contribution to journal › Article
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Mark
Prediction and rationalization of the pH dependence of the activity and stability of family 11 xylanases
(
- Contribution to journal › Article