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The Journal of Physical Chemistry. B
|
April 14, 2023
Origins of the Failure of the Activity Virial Series
David A Kofke
The Journal of Chemical Physics
|
July 21, 2004
Comment on "The incomplete beta function law for parallel tempering sampling of classical canonical systems" [J. Chem. Phys. 120, 4119 (2004)]
David A Kofke
The Journal of Chemical Physics
|
November 6, 2004
Model for small-sample bias of free-energy calculations applied to Gaussian-distributed nonequilibrium work measurements
Di Wu, David A Kofke
The Journal of Chemical Physics
|
August 20, 2005
Phase-space overlap measures. I. Fail-safe bias detection in free energies calculated by molecular simulation
Di Wu, David A Kofke
The Journal of Chemical Physics
|
June 11, 2005
Selection of temperature intervals for parallel-tempering simulations
Aminata Kone, David A Kofke
Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics
|
February 9, 2005
Asymmetric bias in free-energy perturbation measurements using two Hamiltonian-based models
Di Wu, David A Kofke
The Journal of Chemical Physics
|
June 11, 2005
Rosenbluth-sampled nonequilibrium work method for calculation of free energies in molecular simulation
Di Wu, David A Kofke
The Journal of Chemical Physics
|
September 17, 2005
Phase-space overlap measures. II. Design and implementation of staging methods for free-energy calculations
Di Wu, David A Kofke
Journal of the American Chemical Society
|
January 13, 2005
Trimer based polarization as a multibody molecular model. Application to hydrogen fluoride
Scott J Wierzchowski, David A Kofke
Journal of Computational Chemistry
|
January 8, 2015
Etomica: an object-oriented framework for molecular simulation
Andrew J Schultz, David A Kofke
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of 6
Search research articles
Search
Showing results (1-10 of 57) with videos related to
Sort By:
Page
of 6
The Journal of Physical Chemistry. B
|
April 14, 2023
Origins of the Failure of the Activity Virial Series
David A Kofke
The Journal of Chemical Physics
|
July 21, 2004
Comment on "The incomplete beta function law for parallel tempering sampling of classical canonical systems" [J. Chem. Phys. 120, 4119 (2004)]
David A Kofke
The Journal of Chemical Physics
|
November 6, 2004
Model for small-sample bias of free-energy calculations applied to Gaussian-distributed nonequilibrium work measurements
Di Wu, David A Kofke
The Journal of Chemical Physics
|
August 20, 2005
Phase-space overlap measures. I. Fail-safe bias detection in free energies calculated by molecular simulation
Di Wu, David A Kofke
The Journal of Chemical Physics
|
June 11, 2005
Selection of temperature intervals for parallel-tempering simulations
Aminata Kone, David A Kofke
Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics
|
February 9, 2005
Asymmetric bias in free-energy perturbation measurements using two Hamiltonian-based models
Di Wu, David A Kofke
The Journal of Chemical Physics
|
June 11, 2005
Rosenbluth-sampled nonequilibrium work method for calculation of free energies in molecular simulation
Di Wu, David A Kofke
The Journal of Chemical Physics
|
September 17, 2005
Phase-space overlap measures. II. Design and implementation of staging methods for free-energy calculations
Di Wu, David A Kofke
Journal of the American Chemical Society
|
January 13, 2005
Trimer based polarization as a multibody molecular model. Application to hydrogen fluoride
Scott J Wierzchowski, David A Kofke
Journal of Computational Chemistry
|
January 8, 2015
Etomica: an object-oriented framework for molecular simulation
Andrew J Schultz, David A Kofke
Page
of 6