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Biophysical Journal
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August 5, 2009
Evaluating the performance of the ff99SB force field based on NMR scalar coupling data
Lauren Wickstrom, Asim Okur, Carlos Simmerling
Journal of Chemical Theory and Computation
|
December 2, 2015
Evaluation of Salt Bridge Structure and Energetics in Peptides Using Explicit, Implicit, and Hybrid Solvation Models
Asim Okur, Lauren Wickstrom, Carlos Simmerling
The Journal of Physical Chemistry. B
|
February 16, 2007
Coupling of replica exchange simulations to a non-Boltzmann structure reservoir
Adrian E Roitberg, Asim Okur, Carlos Simmerling
Chemical Physics Letters
|
October 23, 2012
MDMS: Molecular Dynamics Meta-Simulator for evaluating exchange type sampling methods
Daniel B Smith, Asim Okur, Bernard Brooks
Journal of Computational Chemistry
|
December 17, 2002
Using PC clusters to evaluate the transferability of molecular mechanics force fields for proteins
Asim Okur, Bentley Strockbine, Viktor Hornak, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
January 19, 2006
HIV-1 protease flaps spontaneously open and reclose in molecular dynamics simulations
Viktor Hornak, Asim Okur, Robert C Rizzo, et al.
Journal of the American Chemical Society
|
March 2, 2006
HIV-1 protease flaps spontaneously close to the correct structure in simulations following manual placement of an inhibitor into the open state
Viktor Hornak, Asim Okur, Robert C Rizzo, et al.
The Journal of Chemical Physics
|
August 24, 2018
Reservoir pH replica exchange
Ana Damjanovic, Benjamin T Miller, Asim Okur, et al.
Journal of Molecular Graphics & Modelling
|
December 21, 2010
Improving the description of salt bridge strength and geometry in a Generalized Born model
Yi Shang, Hai Nguyen, Lauren Wickstrom, et al.
The Journal of Physical Chemistry. B
|
January 30, 2007
Secondary structure bias in generalized Born solvent models: comparison of conformational ensembles and free energy of solvent polarization from explicit and implicit solvation
Daniel R Roe, Asim Okur, Lauren Wickstrom, et al.
Page
of 2
Search research articles
Search
Showing results (1-10 of 16) with videos related to
Sort By:
Page
of 2
Biophysical Journal
|
August 5, 2009
Evaluating the performance of the ff99SB force field based on NMR scalar coupling data
Lauren Wickstrom, Asim Okur, Carlos Simmerling
Journal of Chemical Theory and Computation
|
December 2, 2015
Evaluation of Salt Bridge Structure and Energetics in Peptides Using Explicit, Implicit, and Hybrid Solvation Models
Asim Okur, Lauren Wickstrom, Carlos Simmerling
The Journal of Physical Chemistry. B
|
February 16, 2007
Coupling of replica exchange simulations to a non-Boltzmann structure reservoir
Adrian E Roitberg, Asim Okur, Carlos Simmerling
Chemical Physics Letters
|
October 23, 2012
MDMS: Molecular Dynamics Meta-Simulator for evaluating exchange type sampling methods
Daniel B Smith, Asim Okur, Bernard Brooks
Journal of Computational Chemistry
|
December 17, 2002
Using PC clusters to evaluate the transferability of molecular mechanics force fields for proteins
Asim Okur, Bentley Strockbine, Viktor Hornak, et al.
Proceedings of the National Academy of Sciences of the United States of America
|
January 19, 2006
HIV-1 protease flaps spontaneously open and reclose in molecular dynamics simulations
Viktor Hornak, Asim Okur, Robert C Rizzo, et al.
Journal of the American Chemical Society
|
March 2, 2006
HIV-1 protease flaps spontaneously close to the correct structure in simulations following manual placement of an inhibitor into the open state
Viktor Hornak, Asim Okur, Robert C Rizzo, et al.
The Journal of Chemical Physics
|
August 24, 2018
Reservoir pH replica exchange
Ana Damjanovic, Benjamin T Miller, Asim Okur, et al.
Journal of Molecular Graphics & Modelling
|
December 21, 2010
Improving the description of salt bridge strength and geometry in a Generalized Born model
Yi Shang, Hai Nguyen, Lauren Wickstrom, et al.
The Journal of Physical Chemistry. B
|
January 30, 2007
Secondary structure bias in generalized Born solvent models: comparison of conformational ensembles and free energy of solvent polarization from explicit and implicit solvation
Daniel R Roe, Asim Okur, Lauren Wickstrom, et al.
Page
of 2