Shinji Saito

教授/Professor

分子科学研究所/Institute for Molecular Science

Japan

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About

Shinji Saito is a Professor at the Institute for Molecular Science in Japan. His research encompasses various areas, including molecular dynamics, the properties of water in nanostructures, and the analysis of energy functions in quantum chemistry. Recent articles co-authored by Professor Saito explore topics such as the mechanisms of phosphorylation in molecular systems and the effects of ions on interfacial structures. His work contributes significantly to the understanding of molecular interactions and reaction dynamics.

Articles (20)

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2025

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2025

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2025

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2025

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2025

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2025

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2025

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2024

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2024

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2024

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2023

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2023

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2022

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2022

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2022

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2022

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2022

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2021

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2021

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2021

Collaborators (8)

Miho Hatanaka

Associate Professor

Keio University

JAPAN

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Yoshihiko Furuike

The Graduate University for Advanced Studies, SOKENDAI

JAPAN

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Taichi Inagaki

Assistant Professor

Keio University

JAPAN

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Eiki Yamashita

Osaka University

JAPAN

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Toshifumi Mori

准教授/Associate Professor

Kyushu University

JAPAN

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Shuji AKIYAMA

教授/Professor

分子科学研究所/Institute for Molecular Science

JAPAN

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Shin-ichi Koda

助教/Assistant Professor

分子科学研究所/Institute for Molecular Science

JAPAN

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Shigetoshi Oiki

Specially Appointed Professor

University of Fukui

JAPAN

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Shinji Saito

Research Interests

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About

Articles (20)

A Rigorous Expression of the Hohenberg–Kohn Universal Energy Functional Based on the Analysis of the Spatial Scaling Property of the Kohn–Sham Potential

Faster Diffusion of Water along Carbon Nanotubes near the Wall

The priming phosphorylation of KaiC is activated by the release of its autokinase autoinhibition

Correlated Flat-Bottom Elastic Network Model for Improved Bond Rearrangement in Reaction Paths

Reactive molecular dynamics simulations of the intra- and intermolecular reactions of hydrogen-abstracted polyethylene chains

Development of Molecular Dynamics Parameters and Theoretical Analysis of Excitonic and Optical Properties in the Light-Harvesting Complex II

Effects of cations on the structure, dynamics and vibrational sum frequency generation spectroscopy of liquid/vapor interfaces of aqueous solutions of monovalent and divalent metal nitrates

Flat-Bottom Elastic Network Model for Generating Improved Plausible Reaction Paths

Erratum: “Unraveling the dynamic slowdown in supercooled water: The role of dynamic disorder in jump motions” [J. Chem. Phys. 160, 194506 (2024)]

Unraveling the dynamic slowdown in supercooled water: The role of dynamic disorder in jump motions

Anisotropic and Finite Effects on Intermolecular Vibration and Relaxation Dynamics: Low-Frequency Raman Spectroscopy of Water Film and Droplet on Graphene by Molecular Dynamics Simulations

Kohn–Sham potentials by an inverse Kohn–Sham equation and accuracy assessment by virial theorem

Regulation mechanisms of the dual ATPase in KaiC

Molecular Insights into the Intrinsic Dynamics and Their Roles During Catalysis in Pin1 Peptidyl-prolyl Isomerase

Hybrid Monte Carlo method with potential scaling for sampling from the canonical multimodal distribution and imitating the relaxation process

Multimeric structure enables the acceleration of KaiB-KaiC complex formation induced by ADP/ATP exchange inhibition

Excited states of chlorophyll a and b in solution by time-dependent density functional theory

Vectorial insertion of a β-helical peptide into membrane: a theoretical study on polytheonamide B

Dynamical Behavior of Water; Fluctuation, Reactions and Phase Transitions

Tetrahedral structure of supercooled water at ambient pressure and its influence on dynamic relaxation: Comparative study of water models

Collaborators (8)

Miho Hatanaka

Yoshihiko Furuike

Taichi Inagaki

Eiki Yamashita

Toshifumi Mori

Shuji AKIYAMA

Shin-ichi Koda

Shigetoshi Oiki

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