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Fumio Hirata

Showing results (11-20 of 66) with videos related to

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Journal of Computational Chemistry|October 30, 2007
Combination of molecular dynamics method and 3D-RISM theory for conformational sampling of large flexible molecules in solutionTatsuhiko Miyata, Fumio Hirata
Physical Chemistry Chemical Physics : PCCP|October 1, 2009
A molecular theory of liquid interfacesAndriy Kovalenko, Fumio Hirata
Journal of Chemical Theory and Computation|November 26, 2015
Modified Anderson Method for Accelerating 3D-RISM Calculations Using Graphics Processing UnitYutaka Maruyama, Fumio Hirata
The Journal of Chemical Physics|February 9, 2007
Statistical-mechanical theory of ultrasonic absorption in molecular liquidsAlexander E Kobryn, Fumio Hirata
The Journal of Physical Chemistry. B|May 17, 2013
Analysis of biomolecular solvation sites by 3D-RISM theoryDaniel J Sindhikara, Fumio Hirata
The Journal of Chemical Physics|February 2, 2011
Free energy calculation using molecular dynamics simulation combined with the three-dimensional reference interaction site model theory. II. Thermodynamic integration along a spatial reaction coordinateTatsuhiko Miyata, Yasuhiro Ikuta, Fumio Hirata
The Journal of Physical Chemistry. B|July 21, 2006
Partial molar volume of proteins studied by the three-dimensional reference interaction site model theoryTakashi Imai, Andriy Kovalenko, Fumio Hirata
Current Pharmaceutical Design|May 31, 2011
Molecular recognition explored by a statistical-mechanics theory of liquidsSaree Phongphanphanee, Norio Yoshida, Fumio Hirata
The Journal of Chemical Physics|August 7, 2010
Free energy calculation using molecular dynamics simulation combined with the three dimensional reference interaction site model theory. I. Free energy perturbation and thermodynamic integration along a coupling parameterTatsuhiko Miyata, Yasuhiro Ikuta, Fumio Hirata
The Journal of Physical Chemistry. B|August 27, 2009
Solvation dynamics in polar solvents studied by means of RISM/mode-coupling theoryKatsura Nishiyama, Tsuyoshi Yamaguchi, Fumio Hirata
Pageof 7

Showing results (11-20 of 66) with videos related to

Sort By:
Pageof 7
Journal of Computational Chemistry|October 30, 2007
Combination of molecular dynamics method and 3D-RISM theory for conformational sampling of large flexible molecules in solutionTatsuhiko Miyata, Fumio Hirata
Physical Chemistry Chemical Physics : PCCP|October 1, 2009
A molecular theory of liquid interfacesAndriy Kovalenko, Fumio Hirata
Journal of Chemical Theory and Computation|November 26, 2015
Modified Anderson Method for Accelerating 3D-RISM Calculations Using Graphics Processing UnitYutaka Maruyama, Fumio Hirata
The Journal of Chemical Physics|February 9, 2007
Statistical-mechanical theory of ultrasonic absorption in molecular liquidsAlexander E Kobryn, Fumio Hirata
The Journal of Physical Chemistry. B|May 17, 2013
Analysis of biomolecular solvation sites by 3D-RISM theoryDaniel J Sindhikara, Fumio Hirata
The Journal of Chemical Physics|February 2, 2011
Free energy calculation using molecular dynamics simulation combined with the three-dimensional reference interaction site model theory. II. Thermodynamic integration along a spatial reaction coordinateTatsuhiko Miyata, Yasuhiro Ikuta, Fumio Hirata
The Journal of Physical Chemistry. B|July 21, 2006
Partial molar volume of proteins studied by the three-dimensional reference interaction site model theoryTakashi Imai, Andriy Kovalenko, Fumio Hirata
Current Pharmaceutical Design|May 31, 2011
Molecular recognition explored by a statistical-mechanics theory of liquidsSaree Phongphanphanee, Norio Yoshida, Fumio Hirata
The Journal of Chemical Physics|August 7, 2010
Free energy calculation using molecular dynamics simulation combined with the three dimensional reference interaction site model theory. I. Free energy perturbation and thermodynamic integration along a coupling parameterTatsuhiko Miyata, Yasuhiro Ikuta, Fumio Hirata
The Journal of Physical Chemistry. B|August 27, 2009
Solvation dynamics in polar solvents studied by means of RISM/mode-coupling theoryKatsura Nishiyama, Tsuyoshi Yamaguchi, Fumio Hirata
Pageof 7