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- 2010
-
Mark
A NEMO potential that includes the dipole-quadrupole and quadrupole-quadrupole polarizability.
(
- Contribution to journal › Article
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Mark
How to obtain statistically converged MM/GBSA results.
(
- Contribution to journal › Article
-
Mark
Software News and Update MOLCAS 7: The Next Generation
(
- Contribution to journal › Scientific review
- 2009
-
Mark
Conformational dependence of charges in protein simulations
(
- Contribution to journal › Article
- 2008
-
Mark
Inclusion of the quadrupole moment when describing polarization. The effect of the dipole-quadrupole polarizability.
(
- Contribution to journal › Article
-
Mark
Induction correction model for rotation of two or three dihedral angles.
(
- Contribution to journal › Article
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Mark
An intramolecular induction correction model of the molecular dipole moment.
(
- Contribution to journal › Article
- 2007
-
Mark
Accuracy of distributed multipoles and polarizabilities: Comparison between the LoProp and MpProp models
(
- Contribution to journal › Article
- 2006
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Mark
PROFASI: A Monte Carlo simulation package for protein folding and aggregation
(
- Contribution to journal › Article
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Mark
The reaction mechanism of iron and manganese superoxide dismutases studied by theoretical calculations
(
- Contribution to journal › Article