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The Journal of Chemical Physics
|
June 21, 2006
A combined explicit-implicit method for high accuracy reaction path integration
Steven K Burger, Weitao Yang
The Journal of Chemical Physics
|
January 4, 2007
Automatic integration of the reaction path using diagonally implicit Runge-Kutta methods
Steven K Burger, Weitao Yang
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
August 1, 2014
Linear-scaling quantum calculations using non-orthogonal localized molecular orbitals
Steven K Burger, Weitao Yang
The Journal of Chemical Physics
|
February 14, 2006
Quadratic string method for determining the minimum-energy path based on multiobjective optimization
Steven K Burger, Weitao Yang
The Journal of Chemical Physics
|
November 6, 2007
Sequential quadratic programming method for determining the minimum energy path
Steven K Burger, Weitao Yang
The Journal of Chemical Physics
|
June 25, 2010
Methods for finding transition states on reduced potential energy surfaces
Steven K Burger, Paul W Ayers
Journal of Computational Chemistry
|
July 6, 2013
Efficient optimization of van der Waals parameters from bulk properties
Steven K Burger, G Andrés Cisneros
Proteins
|
May 11, 2011
A parameterized, continuum electrostatic model for predicting protein pKa values
Steven K Burger, Paul W Ayers
Journal of Chemical Theory and Computation
|
December 1, 2015
Dual Grid Methods for Finding the Reaction Path on Reduced Potential Energy Surfaces
Steven K Burger, Paul W Ayers
Journal of Computational Chemistry
|
April 28, 2011
Empirical prediction of protein pKa values with residue mutation
Steven K Burger, Paul W Ayers
Page
of 3
Search research articles
Search
Showing results (1-10 of 24) with videos related to
Sort By:
Page
of 3
The Journal of Chemical Physics
|
June 21, 2006
A combined explicit-implicit method for high accuracy reaction path integration
Steven K Burger, Weitao Yang
The Journal of Chemical Physics
|
January 4, 2007
Automatic integration of the reaction path using diagonally implicit Runge-Kutta methods
Steven K Burger, Weitao Yang
Journal of Physics. Condensed Matter : an Institute of Physics Journal
|
August 1, 2014
Linear-scaling quantum calculations using non-orthogonal localized molecular orbitals
Steven K Burger, Weitao Yang
The Journal of Chemical Physics
|
February 14, 2006
Quadratic string method for determining the minimum-energy path based on multiobjective optimization
Steven K Burger, Weitao Yang
The Journal of Chemical Physics
|
November 6, 2007
Sequential quadratic programming method for determining the minimum energy path
Steven K Burger, Weitao Yang
The Journal of Chemical Physics
|
June 25, 2010
Methods for finding transition states on reduced potential energy surfaces
Steven K Burger, Paul W Ayers
Journal of Computational Chemistry
|
July 6, 2013
Efficient optimization of van der Waals parameters from bulk properties
Steven K Burger, G Andrés Cisneros
Proteins
|
May 11, 2011
A parameterized, continuum electrostatic model for predicting protein pKa values
Steven K Burger, Paul W Ayers
Journal of Chemical Theory and Computation
|
December 1, 2015
Dual Grid Methods for Finding the Reaction Path on Reduced Potential Energy Surfaces
Steven K Burger, Paul W Ayers
Journal of Computational Chemistry
|
April 28, 2011
Empirical prediction of protein pKa values with residue mutation
Steven K Burger, Paul W Ayers
Page
of 3