Shigehiko Hayashi

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 10

Top Topics

Molecular Dynamics Simulations

High Efficiency

Acinetobacter Baumannii

Top Venues

The journal of physical chemistry. B

Science advances

Journal of chemical information and modeling

Journal of computational chemistry

This page only lists publications with an associated author ORCID identifier.

Publications

Takafumi Shikakura, Cheng Cheng, Taisuke Hasegawa, Shigehiko Hayashi
Exploring Protonation State, Ion Binding, and Photoactivated Channel Opening of an Anion Channelrhodopsin by Molecular Simulations. The journal of physical chemistry. B (2024)
Yuki Yamamoto, Fengniu Lu, Takashi Nakanishi, Shigehiko Hayashi
Liquid Structures and Diffusion Dynamics of Alkyl-Pyrene Liquids Studied by Molecular Dynamics Simulations. The journal of physical chemistry. B (2023)
Yuki Yamamoto, Fengniu Lu, Takashi Nakanishi, Shigehiko Hayashi
Liquid Structures and Diffusion Dynamics of Alkyl-Pyrene Liquids Studied by Molecular Dynamics Simulations. The journal of physical chemistry. B (2023)
Zixuan Li, Misao Mizuno, Tomo Ejiri, Shigehiko Hayashi, Hideki Kandori, Yasuhisa Mizutani
Unique Vibrational Characteristics and Structures of the Photoexcited Retinal Chromophore in Ion-Pumping Rhodopsins. The journal of physical chemistry. B (2023)
Yuki Yamamoto, Fengniu Lu, Takashi Nakanishi, Shigehiko Hayashi
Liquid Structures and Diffusion Dynamics of Alkyl-Pyrene Liquids Studied by Molecular Dynamics Simulations. The journal of physical chemistry. B (2023)
Masahiko Taguchi, Ryo Oyama, Masahiro Kaneso, Shigehiko Hayashi
Hybrid QM/MM Free-Energy Evaluation of Drug-Resistant Mutational Effect on the Binding of an Inhibitor Indinavir to HIV-1 Protease. Journal of chemical information and modeling 62 (5) (2022)
Cheng Cheng, Shigehiko Hayashi
Ab Initio Evaluation of the Redox Potential of Cytochrome c. Journal of chemical theory and computation 17 (2) (2021)
Shoichi Tanimoto, Koichi Tamura, Shigehiko Hayashi, Norio Yoshida, Haruyuki Nakano
A computational method to simulate global conformational changes of proteins induced by cosolvent. Journal of computational chemistry 42 (8) (2021)
Masahiro Yamashina, Munetaka Akita, Taisuke Hasegawa, Shigehiko Hayashi, Michito Yoshizawa
A polyaromatic nanocapsule as a sucrose receptor in water. Science advances 3 (8) (2017)
Motoshi Kamiya, Shigehiko Hayashi
Photoactivation Intermediates of a G-Protein Coupled Receptor Rhodopsin Investigated by a Hybrid Molecular Simulation. The journal of physical chemistry. B 121 (15) (2017)