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- 2011
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Mark
Conformational Dependence of Isotropic Polarizabilities
(
- Contribution to journal › Article
- 2010
-
Mark
Estimates of ligand-binding affinities supported by quantum mechanical methods.
(
- Contribution to journal › Article
-
Mark
Nonpolar Solvation Free Energies of Protein-Ligand Complexes
(
- Contribution to journal › Article
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Mark
Ligand affinities estimated by quantum chemical calculations
(
- Contribution to journal › Article
- 2009
-
Mark
An improved method to predict the entropy term with the MM/PBSA approach.
(
- Contribution to journal › Article
- 2008
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Mark
Transition-state docking of flunitrazepam and progesterone in cytochrome P450
(
- Contribution to journal › Article
- 2007
-
Mark
Prediction and rationalization of the pH dependence of the activity and stability of family 11 xylanases
(
- Contribution to journal › Article