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The Journal of Physical Chemistry. A
|
October 24, 2009
Are current semiempirical methods better than force fields? A study from the thermodynamics perspective
Gustavo de M Seabra, Ross C Walker, Adrian E Roitberg
Journal of Chemical Theory and Computation
|
November 24, 2015
Application of Adaptive QM/MM Methods to Molecular Dynamics Simulations of Aqueous Systems
Kyoyeon Park, Andreas W Götz, Ross C Walker, et al.
Biophysical Journal
|
March 13, 2015
Speed of conformational change: comparing explicit and implicit solvent molecular dynamics simulations
Ramu Anandakrishnan, Aleksander Drozdetski, Ross C Walker, et al.
Cell Biochemistry and Biophysics
|
March 15, 2016
Single Active Site Mutation Causes Serious Resistance of HIV Reverse Transcriptase to Lamivudine: Insight from Multiple Molecular Dynamics Simulations
Suri Moonsamy, Soumendranath Bhakat, Ross C Walker, et al.
Journal of Chemical Theory and Computation
|
August 20, 2014
Influence of Sequence and Covalent Modifications on Yeast tRNA Dynamics
Xiaoju Zhang, Ross C Walker, Eric M Phizicky, et al.
The Journal of Physical Chemistry. B
|
August 25, 2012
LIPID11: a modular framework for lipid simulations using amber
Åge A Skjevik, Benjamin D Madej, Ross C Walker, et al.
Journal of Chemical Theory and Computation
|
November 5, 2013
Improving the Efficiency of Free Energy Calculations in the Amber Molecular Dynamics Package
Joseph W Kaus, Levi T Pierce, Ross C Walker, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
June 28, 2017
CRISPR-Cas9 conformational activation as elucidated from enhanced molecular simulations
Giulia Palermo, Yinglong Miao, Ross C Walker, et al.
The Journal of Physical Chemistry. B
|
October 21, 2015
Toward an Enhanced Sampling Molecular Dynamics Method for Studying Ligand-Induced Conformational Changes in Proteins
Ole Juul Andersen, Julie Grouleff, Perri Needham, et al.
Journal of Computational Chemistry
|
December 23, 2006
Comparison of basis set effects and the performance of ab initio and DFT methods for probing equilibrium fluctuations
Ross C Walker, Ian P Mercer, Ian R Gould, et al.
Page
of 6
Search research articles
Search
Showing results (11-20 of 60) with videos related to
Sort By:
Page
of 6
The Journal of Physical Chemistry. A
|
October 24, 2009
Are current semiempirical methods better than force fields? A study from the thermodynamics perspective
Gustavo de M Seabra, Ross C Walker, Adrian E Roitberg
Journal of Chemical Theory and Computation
|
November 24, 2015
Application of Adaptive QM/MM Methods to Molecular Dynamics Simulations of Aqueous Systems
Kyoyeon Park, Andreas W Götz, Ross C Walker, et al.
Biophysical Journal
|
March 13, 2015
Speed of conformational change: comparing explicit and implicit solvent molecular dynamics simulations
Ramu Anandakrishnan, Aleksander Drozdetski, Ross C Walker, et al.
Cell Biochemistry and Biophysics
|
March 15, 2016
Single Active Site Mutation Causes Serious Resistance of HIV Reverse Transcriptase to Lamivudine: Insight from Multiple Molecular Dynamics Simulations
Suri Moonsamy, Soumendranath Bhakat, Ross C Walker, et al.
Journal of Chemical Theory and Computation
|
August 20, 2014
Influence of Sequence and Covalent Modifications on Yeast tRNA Dynamics
Xiaoju Zhang, Ross C Walker, Eric M Phizicky, et al.
The Journal of Physical Chemistry. B
|
August 25, 2012
LIPID11: a modular framework for lipid simulations using amber
Åge A Skjevik, Benjamin D Madej, Ross C Walker, et al.
Journal of Chemical Theory and Computation
|
November 5, 2013
Improving the Efficiency of Free Energy Calculations in the Amber Molecular Dynamics Package
Joseph W Kaus, Levi T Pierce, Ross C Walker, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
June 28, 2017
CRISPR-Cas9 conformational activation as elucidated from enhanced molecular simulations
Giulia Palermo, Yinglong Miao, Ross C Walker, et al.
The Journal of Physical Chemistry. B
|
October 21, 2015
Toward an Enhanced Sampling Molecular Dynamics Method for Studying Ligand-Induced Conformational Changes in Proteins
Ole Juul Andersen, Julie Grouleff, Perri Needham, et al.
Journal of Computational Chemistry
|
December 23, 2006
Comparison of basis set effects and the performance of ab initio and DFT methods for probing equilibrium fluctuations
Ross C Walker, Ian P Mercer, Ian R Gould, et al.
Page
of 6