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Yakugaku Zasshi : Journal of the Pharmaceutical Society of Japan
|
August 2, 2011
[Large scale quantum chemical calculation for drug discovery]
Kazuo Kitaura
The Journal of Chemical Physics
|
July 30, 2004
Second order Møller-Plesset perturbation theory based upon the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Physical Chemistry. A
|
March 8, 2016
Subsystem Analysis for the Fragment Molecular Orbital Method and Its Application to Protein-Ligand Binding in Solution
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Chemical Physics
|
March 3, 2005
Multiconfiguration self-consistent-field theory based upon the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
Journal of Computational Chemistry
|
November 17, 2006
Pair interaction energy decomposition analysis
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Chemical Physics
|
October 15, 2005
Coupled-cluster theory based upon the fragment molecular-orbital method
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Chemical Physics
|
July 23, 2004
The importance of three-body terms in the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Physical Chemistry. A
|
January 17, 2018
Pair Interaction Energy Decomposition Analysis for Density Functional Theory and Density-Functional Tight-Binding with an Evaluation of Energy Fluctuations in Molecular Dynamics
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Physical Chemistry. A
|
November 22, 2011
Energy decomposition analysis in solution based on the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Physical Chemistry. A
|
May 22, 2007
Extending the power of quantum chemistry to large systems with the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
Page
of 8
Search research articles
Search
Showing results (1-10 of 75) with videos related to
Sort By:
Page
of 8
Yakugaku Zasshi : Journal of the Pharmaceutical Society of Japan
|
August 2, 2011
[Large scale quantum chemical calculation for drug discovery]
Kazuo Kitaura
The Journal of Chemical Physics
|
July 30, 2004
Second order Møller-Plesset perturbation theory based upon the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Physical Chemistry. A
|
March 8, 2016
Subsystem Analysis for the Fragment Molecular Orbital Method and Its Application to Protein-Ligand Binding in Solution
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Chemical Physics
|
March 3, 2005
Multiconfiguration self-consistent-field theory based upon the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
Journal of Computational Chemistry
|
November 17, 2006
Pair interaction energy decomposition analysis
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Chemical Physics
|
October 15, 2005
Coupled-cluster theory based upon the fragment molecular-orbital method
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Chemical Physics
|
July 23, 2004
The importance of three-body terms in the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Physical Chemistry. A
|
January 17, 2018
Pair Interaction Energy Decomposition Analysis for Density Functional Theory and Density-Functional Tight-Binding with an Evaluation of Energy Fluctuations in Molecular Dynamics
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Physical Chemistry. A
|
November 22, 2011
Energy decomposition analysis in solution based on the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
The Journal of Physical Chemistry. A
|
May 22, 2007
Extending the power of quantum chemistry to large systems with the fragment molecular orbital method
Dmitri G Fedorov, Kazuo Kitaura
Page
of 8