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Journal of Chemical Information and Modeling
|
September 22, 2021
Accurate Binding Configuration Prediction of a G-Protein-Coupled Receptor to Its Antagonist Using Multicanonical Molecular Dynamics-Based Dynamic Docking
Gert-Jan Bekker, Mitsugu Araki, Kanji Oshima, et al.
Journal of Chemical Information and Modeling
|
December 28, 2016
The Effect of Conformational Flexibility on Binding Free Energy Estimation between Kinases and Their Inhibitors
Mitsugu Araki, Narutoshi Kamiya, Miwa Sato, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Molecular Dynamics Simulations Accelerated by GPU for Biological Macromolecules with a Non-Ewald Scheme for Electrostatic Interactions
Tadaaki Mashimo, Yoshifumi Fukunishi, Narutoshi Kamiya, et al.
Protein Engineering, Design & Selection : PEDS
|
June 24, 2016
Elastic properties of dynein motor domain obtained from all-atom molecular dynamics simulations
Narutoshi Kamiya, Tadaaki Mashimo, Yu Takano, et al.
The Journal of Physiological Sciences : JPS
|
November 27, 2008
In silico prediction of the chemical block of human ether-a-go-go-related gene (hERG) K+ current
Atsushi Inanobe, Narutoshi Kamiya, Shingo Murakami, et al.
Journal of Chemical Theory and Computation
|
May 10, 2017
Accurate Prediction of Complex Structure and Affinity for a Flexible Protein Receptor and Its Inhibitor
Gert-Jan Bekker, Narutoshi Kamiya, Mitsugu Araki, et al.
The Journal of Biological Chemistry
|
February 8, 2005
Alpha,beta-unsaturated ketone is a core moiety of natural ligands for covalent binding to peroxisome proliferator-activated receptor gamma
Takuma Shiraki, Narutoshi Kamiya, Sayaka Shiki, et al.
ACS Chemical Neuroscience
|
January 31, 2018
Core Binding Site of a Thioflavin-T-Derived Imaging Probe on Amyloid β Fibrils Predicted by Computational Methods
Ryoko Kawai, Mitsugu Araki, Masashi Yoshimura, et al.
Journal of Chemical Information and Modeling
|
April 9, 2021
Flexibility and Cell Permeability of Cyclic Ras-Inhibitor Peptides Revealed by the Coupled Nosé-Hoover Equation
Kei Moritsugu, Koh Takeuchi, Narutoshi Kamiya, et al.
Journal of Computational Chemistry
|
June 5, 2008
Application of MDGRAPE-3, a special purpose board for molecular dynamics simulations, to periodic biomolecular systems
Gota Kikugawa, Rossen Apostolov, Narutoshi Kamiya, et al.
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of 7
Search research articles
Search
Showing results (31-40 of 62) with videos related to
Sort By:
Page
of 7
Journal of Chemical Information and Modeling
|
September 22, 2021
Accurate Binding Configuration Prediction of a G-Protein-Coupled Receptor to Its Antagonist Using Multicanonical Molecular Dynamics-Based Dynamic Docking
Gert-Jan Bekker, Mitsugu Araki, Kanji Oshima, et al.
Journal of Chemical Information and Modeling
|
December 28, 2016
The Effect of Conformational Flexibility on Binding Free Energy Estimation between Kinases and Their Inhibitors
Mitsugu Araki, Narutoshi Kamiya, Miwa Sato, et al.
Journal of Chemical Theory and Computation
|
November 24, 2015
Molecular Dynamics Simulations Accelerated by GPU for Biological Macromolecules with a Non-Ewald Scheme for Electrostatic Interactions
Tadaaki Mashimo, Yoshifumi Fukunishi, Narutoshi Kamiya, et al.
Protein Engineering, Design & Selection : PEDS
|
June 24, 2016
Elastic properties of dynein motor domain obtained from all-atom molecular dynamics simulations
Narutoshi Kamiya, Tadaaki Mashimo, Yu Takano, et al.
The Journal of Physiological Sciences : JPS
|
November 27, 2008
In silico prediction of the chemical block of human ether-a-go-go-related gene (hERG) K+ current
Atsushi Inanobe, Narutoshi Kamiya, Shingo Murakami, et al.
Journal of Chemical Theory and Computation
|
May 10, 2017
Accurate Prediction of Complex Structure and Affinity for a Flexible Protein Receptor and Its Inhibitor
Gert-Jan Bekker, Narutoshi Kamiya, Mitsugu Araki, et al.
The Journal of Biological Chemistry
|
February 8, 2005
Alpha,beta-unsaturated ketone is a core moiety of natural ligands for covalent binding to peroxisome proliferator-activated receptor gamma
Takuma Shiraki, Narutoshi Kamiya, Sayaka Shiki, et al.
ACS Chemical Neuroscience
|
January 31, 2018
Core Binding Site of a Thioflavin-T-Derived Imaging Probe on Amyloid β Fibrils Predicted by Computational Methods
Ryoko Kawai, Mitsugu Araki, Masashi Yoshimura, et al.
Journal of Chemical Information and Modeling
|
April 9, 2021
Flexibility and Cell Permeability of Cyclic Ras-Inhibitor Peptides Revealed by the Coupled Nosé-Hoover Equation
Kei Moritsugu, Koh Takeuchi, Narutoshi Kamiya, et al.
Journal of Computational Chemistry
|
June 5, 2008
Application of MDGRAPE-3, a special purpose board for molecular dynamics simulations, to periodic biomolecular systems
Gota Kikugawa, Rossen Apostolov, Narutoshi Kamiya, et al.
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