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- 2007
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Mark
General transition-state force field for cytochrome p450 Hydroxylation
(
- Contribution to journal › Article
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Performance of density functionals for first row transition metal systems
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- Contribution to journal › Article
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Mark
Repulsion between oppositely charged macromolecules or particles
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- Contribution to journal › Article
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Calculation of EPR g tensors for transition-metal complexes based on multiconfigurational perturbation theory (CASPT2)
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- Contribution to journal › Article
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Mark
Theoretical predictions of the coordination of water to the polar headgroup of dimethyldodecylamine-N-oxide
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- Contribution to journal › Article
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Mark
p-Benzoquinone in aqueous solution: Stark shifts in spectra, asymmetry in solvent structure
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- Contribution to journal › Article
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Mark
Electrostatics in macromolecular solutions
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- Chapter in Book/Report/Conference proceeding › Paper in conference proceeding
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Mark
Chemiluminescence of 1,2-dioxetane. Reaction mechanism uncovered
2007) In The Journal of Physical Chemistry Part A: Molecules, Spectroscopy, Kinetics, Environment and General Theory 111(32). p.8013-8019(
- Contribution to journal › Article
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Mark
The charge capacity of the chemical bond
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- 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