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The Journal of Chemical Physics|July 28, 2020
Temperature relaxation in binary hard-sphere mixture system: Molecular dynamics and kinetic theory studyShigenori Tanaka, Kohei ShimamuraJournal of Computational Chemistry|October 12, 2018
Ab initio molecular dynamics study of prebiotic production processes of organic compounds at meteorite impacts on oceanKohei Shimamura, Fuyuki Shimojo, Aiichiro Nakano, et al.Molecules (Basel, Switzerland)|November 13, 2021
Improvement of the Force Field for <i>β</i>-d-Glucose with Machine LearningMakoto Ikejo, Hirofumi Watanabe, Kohei Shimamura, et al.Physical Chemistry Chemical Physics : PCCP|April 25, 2017
Meteorite impacts on ancient oceans opened up multiple NH<sub>3</sub> production pathwaysKohei Shimamura, Fuyuki Shimojo, Aiichiro Nakano, et al.Scientific Reports|December 15, 2016
Meteorite Impact-Induced Rapid NH<sub>3</sub> Production on Early Earth: Ab Initio Molecular Dynamics SimulationKohei Shimamura, Fuyuki Shimojo, Aiichiro Nakano, et al.The Journal of Chemical Physics|October 3, 2019
Guidelines for creating artificial neural network empirical interatomic potential from first-principles molecular dynamics data under specific conditions and its application to α-Ag<sub>2</sub>SeKohei Shimamura, Shogo Fukushima, Akihide Koura, et al.Methods in Molecular Biology (Clifton, N.J.)|November 8, 2022
Protein-Protein Interaction Modelling with the Fragment Molecular Orbital MethodShigenori TanakaPhysical Chemistry Chemical Physics : PCCP|June 16, 2026
Role of triplet correlations in tetrahedral ordering of liquid water: a DFT-RISM study with bridge functionsShigenori TanakaThe Journal of Chemical Physics|August 12, 2017
Correlational and thermodynamic properties of finite-temperature electron liquids in the hypernetted-chain approximationShigenori TanakaThe Journal of Chemical Physics|March 10, 2016
Diffusion Monte Carlo study on temporal evolution of entropy and free energy in nonequilibrium processesShigenori TanakaPageof 17