Publications 2019年 (8 papers) Yuhara, D., Yasuoka, K., Takeya, S. and Muromachi, S., "Anisotropy of dodecahedral water cages for guest gas occupancy in semiclathrate hydrates", Chemical Communications, 55, 10150-10153(2019). (4 pages.) DOI: 10.1039/c9cc05009d Brumby, P. E., Yuhuara, D., Hasegawa, T., Wu, D. T., Sum, A. K. and Yasuoka, K., "Cage occupancies, lattice constants, and guest chemical potentials for structure II hydrogen clathrate hydrate from Gibbs ensemble Monte Carlo simulations", Journal of Chemical Physics, 150, 134503(2019). (15 pages.) DOI: 10.1063/1.5084785 Endo, K., Yuhara, D., Tomobe K. and Yasuoka K., "Detection of molecular behavior that characterizes systems using a deep learning approach", Nanoscale, 11, 10064-10071(2019). (8 pages.) DOI: 10.1039/C9NR00219G Koishi, T., Yasuoka, K. and Zeng, X. C., "Method to Implement Interaction Surfaces with Virtual Companion Particles for Molecular Dynamics Simulations", Journal of Chemical and Engineering Data, 64, 3671-4190(2019). (8 pages.) DOI: 10.1021/acs.jced.8b01230 Tomobe, K., Yamamoto, E. and Yasuoka, K., "Molecular Dynamic Simulations to Probe Water Permeation Pathways of GPCRs", Methods in Molecular Biology, 1947, 21-30(2019). (10 pages.) DOI: 10.1007/978-1-4939-9121-1_2 Nozawa, T., Brumby, P. E., Ayuba, S. and Yasuoka, K., "Ordering in clusters of uniaxial anisotropic particles during homogeneous nucleation and growth", Journal of Chemical Physics, 150, 054903(2019). (13 pages.) DOI: 10.1063/1.5064410 Winarto, W., Yamamoto, E. and Yasuoka, K., "Selectivity of Carbon Nanotubes under An Electric Field on Transferring Water - Alcohol Mixtures", Materials Science and Engineering, 494, 012099(2019). (6 pages.) DOI: 10.1088/1757-899X/494/1/012099 Winarto, W., Yamamoto, E. and Yasuoka, K., "Separation of water-alcohol mixtures using carbon nanotubes under an electric field", Physical Chemistry Chemical Physics, 21, 15431-15438(2019). (8 pages.) DOI: 10.1063/1.5016609

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