E-LIB Suche - Ergebnisse für: Yasuoka, Kenji

1

Hysteresis Elimination for an Anisotropic Liquid-Crystal Mo..:

Kowaguchi, Akie ; Brumby, Paul E. ; Yasuoka, Kenji
Journal of Chemical Information and Modeling. 64 (2024) 12 - p. 4673-4686 , 2024

Link: https://doi.org/10.1021/..

2

Molecular dynamics study on the permeation directionality o..:

Kuribayashi, Naonobu ; Yamamoto, Eiji ; Hirano, Yoshinori.
Biophysical Journal. 123 (2024) 3 - p. 66a-67a , 2024

Link: https://doi.org/10.1016/..

3

Graph-Neural-Network-Based Unsupervised Learning of the Tem..:

Ishiai, Satoki ; Yasuda, Ikki ; Endo, Katsuhiro.
Journal of Chemical Theory and Computation. , 2024

Link: https://doi.org/10.1021/..

4

In-layer inhomogeneity of molecular dynamics in quasi-liqui..:

Yasuda, Ikki ; Endo, Katsuhiro ; Arai, Noriyoshi.
Communications Chemistry. 7 (2024) 1 - p. , 2024

Link: https://doi.org/10.1038/..

5

Unsupervised deep learning for molecular dynamics simulatio..:

Mustali, Jessica ; Yasuda, Ikki ; Hirano, Yoshinori...
RSC Advances. 13 (2023) 48 - p. 34249-34261 , 2023

Link: https://doi.org/10.1039/..

6

Analysis of cation permeation mechanism of ChR2 by molecula..:

Shobu, Kenta ; Hirano, Yoshinori ; Watanabe, Hiroshi.
Biophysical Journal. 122 (2023) 3 - p. 520a-521a , 2023

Link: https://doi.org/10.1016/..

7

Learned pseudo-random number generator: WGAN-GP for generat..:

Okada, Kiyoshiro ; Endo, Katsuhiro ; Yasuoka, Kenji..
PLOS ONE. 18 (2023) 6 - p. e0287025 , 2023

Link: https://doi.org/10.1371/..

8

Construction of full-atomistic polymer amorphous structures..:

Nitta, Hiroya ; Ozawa, Taku ; Yasuoka, Kenji
The Journal of Chemical Physics. 159 (2023) 19 - p. , 2023

Link: https://doi.org/10.1063/..

9

Wetting hysteresis induces effective unidirectional water t..:

Arai, Noriyoshi ; Yamamoto, Eiji ; Koishi, Takahiro...
Nanoscale Horizons. 8 (2023) 5 - p. 652-661 , 2023

Link: https://doi.org/10.1039/..

10

Combining Molecular Dynamics and Machine Learning to Analyz..:

Yasuda, Ikki ; Kobayashi, Yusei ; Endo, Katsuhiro...
ACS Applied Materials & Interfaces. 15 (2023) 6 - p. 8567-8578 , 2023

Link: https://doi.org/10.1021/..

11

Pre-Smectic Ordering and the Unwinding Helix in Monte Carlo..:

Brumby, Paul E. ; Kowaguchi, Akie ; Nozawa, Takuma..
The Journal of Physical Chemistry B. 127 (2023) 32 - p. 7194-7204 , 2023

Link: https://doi.org/10.1021/..

12

Relation in ligand dynamics and protein mutation using unsu..:

Yasuda, Ikki ; Endo, Katsuhiro ; Hirano, Yoshinori..
Biophysical Journal. 122 (2023) 3 - p. 182a , 2023

Link: https://doi.org/10.1016/..

13

Efficient Monte Carlo Sampling for Molecular Systems Using ..:

Endo, Katsuhiro ; Yuhara, Daisuke ; Yasuoka, Kenji
Journal of Chemical Theory and Computation. 18 (2022) 3 - p. 1395-1405 , 2022

Link: https://doi.org/10.1021/..

14

Optimal Replica-Exchange Molecular Simulations in Combinati..:

Kowaguchi, Akie ; Endo, Katsuhiro ; Brumby, Paul E...
Journal of Chemical Information and Modeling. 62 (2022) 24 - p. 6544-6552 , 2022

Link: https://doi.org/10.1021/..

15

A stochastic Hamiltonian formulation applied to dissipative..:

Peng, Linyu ; Arai, Noriyoshi ; Yasuoka, Kenji
Applied Mathematics and Computation. 426 (2022) - p. 127126 , 2022

Link: https://doi.org/10.1016/..