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Nagai, Tetsuro
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1

An exa-scale high-performance molecular dynamics simulation..:

Andoh, Yoshimichi ; Ichikawa, Shin-ichi ; Sakashita, Tatsuya...
The Journal of Chemical Physics.  158 (2023)  19 - p. , 2023
Link: https://doi.org/10.1063/..
 
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2

In-situ observation of an anion exchange membrane at variou..:

Yoshida, Koji ; Nagai, Tetsuro ; Ohara, Koji...
Journal of Molecular Liquids.  391 (2023)  - p. 123197 , 2023
Link: https://doi.org/10.1016/..
 
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3

Prediction of self‐diffusion coefficients of chemically div..:

Baba, Hiromi ; Urano, Ryo ; Nagai, Tetsuro.
Journal of Computational Chemistry.  43 (2022)  28 - p. 1892-1900 , 2022
Link: https://doi.org/10.1002/..
 
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4

Dynamic Monte Carlo calculation generating particle traject..:

Nagai, Tetsuro ; Yoshimori, Akira ; Okazaki, Susumu
The Journal of Chemical Physics.  156 (2022)  15 - p. , 2022
Link: https://doi.org/10.1063/..
 
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5

A hybrid approach to study large conformational transitions..:

Asi, Han ; Dasgupta, Bhaskar ; Nagai, Tetsuro..
Frontiers in Molecular Biosciences.  9 (2022)  - p. , 2022
Link: https://doi.org/10.3389/..
 
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6

Cover Image:

Baba, Hiromi ; Urano, Ryo ; Nagai, Tetsuro.
Journal of Computational Chemistry.  43 (2022)  28 - p. , 2022
Link: https://doi.org/10.1002/..
 
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7

Global diffusion of hydrogen molecules in the heterogeneous..:

Nagai, Tetsuro ; Okazaki, Susumu
The Journal of Chemical Physics.  157 (2022)  5 - p. , 2022
Link: https://doi.org/10.1063/..
 
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8

Three-dimensional free-energy landscape of hydrogen and oxy..:

Nagai, Tetsuro ; Fujimoto, Kazushi ; Okazaki, Susumu
The Journal of Chemical Physics.  156 (2022)  4 - p. , 2022
Link: https://doi.org/10.1063/..
 
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9

Momentum removal to obtain the position‐dependent diffusion..:

Fujimoto, Kazushi ; Nagai, Tetsuro ; Yamaguchi, Tsuyoshi
Journal of Computational Chemistry.  42 (2021)  30 - p. 2136-2144 , 2021
Link: https://doi.org/10.1002/..
 
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10

Position-Dependent Diffusion Constant of Molecules in Heter..:

Nagai, Tetsuro ; Tsurumaki, Shuhei ; Urano, Ryo...
Journal of Chemical Theory and Computation.  16 (2020)  12 - p. 7239-7254 , 2020
Link: https://doi.org/10.1021/..
 
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11

Exploring the impact of proteins on the line tension of a p..:

Bandara, Asanga ; Panahi, Afra ; Pantelopulos, George A...
The Journal of Chemical Physics.  150 (2019)  20 - p. , 2019
Link: https://doi.org/10.1063/..
 
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12

Role of Computational Methods in Going beyond X-ray Crystal..:

Srivastava, Ashutosh ; Nagai, Tetsuro ; Srivastava, Arpita..
International Journal of Molecular Sciences.  19 (2018)  11 - p. 3401 , 2018
Link: https://doi.org/10.3390/..
 
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13

Gaussian mixture model for coarse-grained modeling from XFE:

Nagai, Tetsuro ; Mochizuki, Yuki ; Joti, Yasumasa..
Optics Express.  26 (2018)  20 - p. 26734 , 2018
Link: https://doi.org/10.1364/..
 
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14

Critical size dependence of domain formation observed in co..:

Pantelopulos, George A. ; Nagai, Tetsuro ; Bandara, Asanga..
The Journal of Chemical Physics.  147 (2017)  9 - p. , 2017
Link: https://doi.org/10.1063/..
 
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15

On the use of mass scaling for stable and efficient simulat..:

Nagai, Tetsuro ; Pantelopulos, George A. ; Takahashi, Takuya.
Journal of Computational Chemistry.  37 (2016)  21 - p. 2017-2028 , 2016
Link: https://doi.org/10.1002/..
 
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