Gregory A. Voth
Gregory A. Voth
Haig P. Papazian Distinguished Service Professor, Department of Chemistry, The University of Chicago
E-mail confirmado em uchicago.edu - Página inicial
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Gaussian 03, revision C. 02
MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ...
Gaussian, Inc., Wallingford, CT, 2004
166212004
A multiscale coarse-graining method for biomolecular systems
S Izvekov, GA Voth
The Journal of Physical Chemistry B 109 (7), 2469-2473, 2005
10142005
Unique spatial heterogeneity in ionic liquids
Y Wang, GA Voth
Journal of the American Chemical Society 127 (35), 12192-12193, 2005
9342005
Flexible simple point-charge water model with improved liquid-state properties
Y Wu, HL Tepper, GA Voth
The Journal of chemical physics 124 (2), 024503, 2006
8692006
Gaussian 09, Revision D. 01, 2009, Gaussian
MJ Frisch, GW Trucks, HB Schlegel, GE Scuseria, MA Robb, ...
Inc., Wallingford CT, 2009
757*2009
The multiscale coarse-graining method. I. A rigorous bridge between atomistic and coarse-grained models
WG Noid, JW Chu, GS Ayton, V Krishna, S Izvekov, GA Voth, A Das, ...
The Journal of chemical physics 128 (24), 244114, 2008
6712008
On the structure and dynamics of ionic liquids
MG Del Pópolo, GA Voth
The Journal of Physical Chemistry B 108 (5), 1744-1752, 2004
6492004
Coarse-graining of condensed phase and biomolecular systems
CRC Press, 2009
634*2009
The computer simulation of proton transport in water
UW Schmitt, GA Voth
The Journal of chemical physics 111 (20), 9361-9381, 1999
5921999
Multiscale coarse graining of liquid-state systems
S Izvekov, GA Voth
The Journal of chemical physics 123 (13), 134105, 2005
5802005
Rigorous formulation of quantum transition state theory and its dynamical corrections
GA Voth, D Chandler, WH Miller
The Journal of chemical physics 91 (12), 7749-7760, 1989
5541989
The formulation of quantum statistical mechanics based on the Feynman path centroid density. II. Dynamical properties
J Cao, GA Voth
The Journal of chemical physics 100 (7), 5106-5117, 1994
4971994
Effective force fields for condensed phase systems from ab initio molecular dynamics simulation: A new method for force-matching
S Izvekov, M Parrinello, CJ Burnham, GA Voth
The Journal of chemical physics 120 (23), 10896-10913, 2004
4432004
Multiscale modeling of biomolecular systems: in serial and in parallel
GS Ayton, WG Noid, GA Voth
Current opinion in structural biology 17 (2), 192-198, 2007
4372007
Molecular dynamics simulation of nanostructural organization in ionic liquid/water mixtures
W Jiang, Y Wang, GA Voth
The Journal of Physical Chemistry B 111 (18), 4812-4818, 2007
4322007
Multistate empirical valence bond model for proton transport in water
UW Schmitt, GA Voth
The Journal of Physical Chemistry B 102 (29), 5547-5551, 1998
4301998
Tail aggregation and domain diffusion in ionic liquids
Y Wang, GA Voth
The Journal of Physical Chemistry B 110 (37), 18601-18608, 2006
4072006
Computer simulation of proton solvation and transport in aqueous and biomolecular systems
GA Voth
Accounts of chemical research 39 (2), 143-150, 2006
4032006
The quantum dynamics of an excess proton in water
J Lobaugh, GA Voth
The Journal of chemical physics 104 (5), 2056-2069, 1996
3971996
Coarse-graining methods for computational biology
MG Saunders, GA Voth
Annual review of biophysics 42, 73-93, 2013
3932013
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