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Journal of Chemical Theory and Computation
|
August 1, 2018
Efficient Implementation of NOCI-MP2 Using the Resolution of the Identity Approximation with Application to Charged Dimers and Long C-C Bonds in Ethane Derivatives
Shane R Yost, Martin Head-Gordon
Biopolymers
|
January 1, 1991
Virtual rigid body dynamics
T Head-Gordon, C L Brooks
The Journal of Physical Chemistry Letters
|
June 26, 2018
Electrostatics Generated by a Supramolecular Capsule Stabilizes the Transition State for Carbon-Carbon Reductive Elimination from Gold(III) Complex
Valerie Vaissier Welborn, Teresa Head-Gordon
ACS Central Science
|
February 3, 2021
Catalytic Principles from Natural Enzymes and Translational Design Strategies for Synthetic Catalysts
Wan-Lu Li, Teresa Head-Gordon
Journal of Computational Chemistry
|
October 7, 2010
Reliable protein structure refinement using a physical energy function
Matthew S Lin, Teresa Head-Gordon
The Journal of Physical Chemistry. B
|
March 22, 2012
Evolution of the potential energy landscape with static pulling force for two model proteins
David J Wales, Teresa Head-Gordon
Folding & Design
|
January 16, 1999
The importance of hydration for the kinetics and thermodynamics of protein folding: simplified lattice models
J M Sorenson, T Head-Gordon
Physical Chemistry Chemical Physics : PCCP
|
February 17, 2006
Accuracy and limitations of second-order many-body perturbation theory for predicting vertical detachment energies of solvated-electron clusters
John M Herbert, Martin Head-Gordon
The Journal of Chemical Physics
|
November 10, 2009
Long-range corrected double-hybrid density functionals
Jeng-Da Chai, Martin Head-Gordon
The Journal of Chemical Physics
|
October 17, 2017
Compressed representation of dispersion interactions and long-range electronic correlations
Jérôme F Gonthier, Martin Head-Gordon
Page
of 65
Search research articles
Search
Showing results (121-130 of 649) with videos related to
Sort By:
Page
of 65
Journal of Chemical Theory and Computation
|
August 1, 2018
Efficient Implementation of NOCI-MP2 Using the Resolution of the Identity Approximation with Application to Charged Dimers and Long C-C Bonds in Ethane Derivatives
Shane R Yost, Martin Head-Gordon
Biopolymers
|
January 1, 1991
Virtual rigid body dynamics
T Head-Gordon, C L Brooks
The Journal of Physical Chemistry Letters
|
June 26, 2018
Electrostatics Generated by a Supramolecular Capsule Stabilizes the Transition State for Carbon-Carbon Reductive Elimination from Gold(III) Complex
Valerie Vaissier Welborn, Teresa Head-Gordon
ACS Central Science
|
February 3, 2021
Catalytic Principles from Natural Enzymes and Translational Design Strategies for Synthetic Catalysts
Wan-Lu Li, Teresa Head-Gordon
Journal of Computational Chemistry
|
October 7, 2010
Reliable protein structure refinement using a physical energy function
Matthew S Lin, Teresa Head-Gordon
The Journal of Physical Chemistry. B
|
March 22, 2012
Evolution of the potential energy landscape with static pulling force for two model proteins
David J Wales, Teresa Head-Gordon
Folding & Design
|
January 16, 1999
The importance of hydration for the kinetics and thermodynamics of protein folding: simplified lattice models
J M Sorenson, T Head-Gordon
Physical Chemistry Chemical Physics : PCCP
|
February 17, 2006
Accuracy and limitations of second-order many-body perturbation theory for predicting vertical detachment energies of solvated-electron clusters
John M Herbert, Martin Head-Gordon
The Journal of Chemical Physics
|
November 10, 2009
Long-range corrected double-hybrid density functionals
Jeng-Da Chai, Martin Head-Gordon
The Journal of Chemical Physics
|
October 17, 2017
Compressed representation of dispersion interactions and long-range electronic correlations
Jérôme F Gonthier, Martin Head-Gordon
Page
of 65