Gregory D Hawkins
Gregory D Hawkins
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Parametrized models of aqueous free energies of solvation based on pairwise descreening of solute atomic charges from a dielectric medium
GD Hawkins, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry 100 (51), 19824-19839, 1996
8971996
Pairwise solute descreening of solute charges from a dielectric medium
GD Hawkins, CJ Cramer, DG Truhlar
Chemical Physics Letters 246 (1-2), 122-129, 1995
7191995
Model for aqueous solvation based on class IV atomic charges and first solvation shell effects
CC Chambers, GD Hawkins, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry 100 (40), 16385-16398, 1996
4471996
Extension of the platform of applicability of the SM5. 42R universal solvation model
J Li, T Zhu, GD Hawkins, P Winget, DA Liotard, CJ Cramer, DG Truhlar
Theoretical Chemistry Accounts 103 (1), 9-63, 1999
2581999
Universal quantum mechanical model for solvation free energies based on gas-phase geometries
GD Hawkins, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry B 102 (17), 3257-3271, 1998
1871998
Density functional solvation model based on CM2 atomic charges
T Zhu, J Li, GD Hawkins, CJ Cramer, DG Truhlar
The Journal of chemical physics 109 (20), 9117-9133, 1998
1591998
Improved methods for semiempirical solvation models
DA Liotard, GD Hawkins, GC Lynch, CJ Cramer, DG Truhlar
Journal of computational chemistry 16 (4), 422-440, 1995
1571995
Universal reaction field model based on ab initio Hartree–Fock theory
J Li, GD Hawkins, CJ Cramer, DG Truhlar
Chemical Physics Letters 288 (2-4), 293-298, 1998
1371998
Minnesota Solvation Database, version 2012
AV Marenich, CP Kelly, JD Thompson, GD Hawkins, CC Chambers, ...
University of Minnesota, Minneapolis, 3, 2012
1302012
A universal model for the quantum mechanical calculation of free energies of solvation in non-aqueous solvents
DJ Giesen, GD Hawkins, DA Liotard, CJ Cramer, DG Truhlar
Theoretical Chemistry Accounts 98 (2-3), 85-109, 1997
1221997
Parametrized model for aqueous free energies of solvation using geometry-dependent atomic surface tensions with implicit electrostatics
GD Hawkins, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry B 101 (36), 7147-7157, 1997
1051997
Structure and Reactivity in Aqueous Solution: An Overview
CJ Cramer, DG Truhlar
931994
OMNISOL: Fast prediction of free energies of solvation and partition coefficients
GD Hawkins, DA Liotard, CJ Cramer, DG Truhlar
The Journal of Organic Chemistry 63 (13), 4305-4313, 1998
851998
Universal solvation model based on conductor‐like screening model
DM Dolney, GD Hawkins, P Winget, DA Liotard, CJ Cramer, DG Truhlar
Journal of Computational Chemistry 21 (5), 340-366, 2000
722000
Prediction of vapor pressures from self-solvation free energies calculated by the SM5 series of universal solvation models
P Winget, GD Hawkins, CJ Cramer, DG Truhlar
The Journal of Physical Chemistry B 104 (19), 4726-4734, 2000
612000
GAMESOL–version 3.1
JD Xidos, J Li, T Zhu, GD Hawkins, JD Thompson, YY Chuang, PL Fast, ...
University of Minnesota, Minneapolis, 2002
532002
AMSOL, version 6.5. 3
GD Hawkins, DJ Giesen, GC Lynch, CC Chambers, I Rossi, JW Storer, ...
University of Minnesota, Minneapolis, 1998
531998
mn-gsm, version 1.8
JD Xidos, J Li, JD Thompson, GD Hawkins, PD Winget, T Zhu, D Rinaldi, ...
University of Minnesota: Minneapolis, MN, 2001
342001
Universal solvation models
GD Hawkins, T Zhu, J Li, CC Chambers, DJ Giesen, DA Liotard, ...
291998
Amsol
GD Hawkins, DJ Giesen, GC Lynch, CC Chambers, I Rossi, JW Storer, ...
QCPE Bull 16, 11-13, 1996
291996
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