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Journal of Computational Chemistry
|
October 9, 2016
Rapid QM/MM approach for biomolecular systems under periodic boundary conditions: Combination of the density-functional tight-binding theory and particle mesh Ewald method
Hiroaki Nishizawa, Hisashi Okumura
The Journal of Chemical Physics
|
July 20, 2011
Rigorous non-Born-Oppenheimer theory: combination of explicitly correlated Gaussian method and nuclear orbital plus molecular orbital theory
Minoru Hoshino, Hiroaki Nishizawa, Hiromi Nakai
Carbohydrate Research
|
March 21, 2006
Total synthesis of three naturally occurring 6,8-di-C-glycosylflavonoids: phloretin, naringenin, and apigenin bis-C-beta-D-glucosides
Shingo Sato, Toshiki Akiya, Hiroaki Nishizawa, et al.
Journal of Computational Chemistry
|
March 1, 2019
Temperature-pressure shuffling outlier flooding method enhances the conformational sampling of proteins
Ryuhei Harada, Ryunosuke Yoshino, Hiroaki Nishizawa, et al.
Journal of Molecular Graphics & Modelling
|
July 26, 2019
Parallel cascade selection molecular dynamics to screen for protein complexes generated by rigid docking
Ryuhei Harada, Ryunosuke Yoshino, Hiroaki Nishizawa, et al.
Journal of Computational Chemistry
|
June 19, 2016
Three pillars for achieving quantum mechanical molecular dynamics simulations of huge systems: Divide-and-conquer, density-functional tight-binding, and massively parallel computation
Hiroaki Nishizawa, Yoshifumi Nishimura, Masato Kobayashi, et al.
The Journal of Chemical Physics
|
May 17, 2018
Quantum chemical approach for positron annihilation spectra of atoms and molecules beyond plane-wave approximation
Yasuhiro Ikabata, Risa Aiba, Toru Iwanade, et al.
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of 1
Search research articles
Search
Showing results (1-10 of 7) with videos related to
Sort By:
Page
of 1
Journal of Computational Chemistry
|
October 9, 2016
Rapid QM/MM approach for biomolecular systems under periodic boundary conditions: Combination of the density-functional tight-binding theory and particle mesh Ewald method
Hiroaki Nishizawa, Hisashi Okumura
The Journal of Chemical Physics
|
July 20, 2011
Rigorous non-Born-Oppenheimer theory: combination of explicitly correlated Gaussian method and nuclear orbital plus molecular orbital theory
Minoru Hoshino, Hiroaki Nishizawa, Hiromi Nakai
Carbohydrate Research
|
March 21, 2006
Total synthesis of three naturally occurring 6,8-di-C-glycosylflavonoids: phloretin, naringenin, and apigenin bis-C-beta-D-glucosides
Shingo Sato, Toshiki Akiya, Hiroaki Nishizawa, et al.
Journal of Computational Chemistry
|
March 1, 2019
Temperature-pressure shuffling outlier flooding method enhances the conformational sampling of proteins
Ryuhei Harada, Ryunosuke Yoshino, Hiroaki Nishizawa, et al.
Journal of Molecular Graphics & Modelling
|
July 26, 2019
Parallel cascade selection molecular dynamics to screen for protein complexes generated by rigid docking
Ryuhei Harada, Ryunosuke Yoshino, Hiroaki Nishizawa, et al.
Journal of Computational Chemistry
|
June 19, 2016
Three pillars for achieving quantum mechanical molecular dynamics simulations of huge systems: Divide-and-conquer, density-functional tight-binding, and massively parallel computation
Hiroaki Nishizawa, Yoshifumi Nishimura, Masato Kobayashi, et al.
The Journal of Chemical Physics
|
May 17, 2018
Quantum chemical approach for positron annihilation spectra of atoms and molecules beyond plane-wave approximation
Yasuhiro Ikabata, Risa Aiba, Toru Iwanade, et al.
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of 1