Rchr
J-GLOBAL ID:202101006345252543   Update date: Sep. 30, 2022

KANEMATSU YUSUKE

カネマツ ユウスケ | KANEMATSU YUSUKE
Research field  (2): Computational science ,  Bio-, chemical, and soft-matter physics
Research keywords  (2): computational chemistry ,  physical chemistry
Research theme for competitive and other funds  (5):
  • 2021 - 2024 励起状態化学反応解析のための量子多成分系理論の確立と応用計算
  • 2021 - 2024 ヘムのツボを押さえて使うための構造機能相関解析ツール「PyDISH」の開発
  • 2020 - 2023 重水素科学のための基礎理論の構築と新概念の創出
  • 2017 - 2020 速度論的H/D同位体効果の新規理論解析手法の開発
  • 2014 - 2019 Elucidation of Structure-Function Relationship of Biological Active Sites and New Material Design by Molecular Simulation
Papers (22):
  • Hiroko X. Kondo, Hiroyuki Iizuka, Gen Masumoto, Yuichi Kabaya, Yusuke Kanematsu, Yu Takano. Elucidation of the Correlation between Heme Distortion and Tertiary Structure of the Heme-Binding Pocket Using a Convolutional Neural Network. Biomolecules. 2022. 12. 9. 1172-1172
  • Taro Udagawa, Ikumi Hattori, Yusuke Kanematsu, Takayoshi Ishimoto, Masanori Tachikawa. Nuclear quantum effect and H/D isotope effect in excited state intramolecular proton transfer and electron-induced intramolecular proton transfer reactions in 8-hydroxyquinoline. INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY. 2022
  • Hiroko X. Kondo, Masanori Fujii, Takuma Tanioka, Yusuke Kanematsu, Takashi Yoshida, Yu Takano. Global Analysis of Heme Proteins Elucidates the Correlation between Heme Distortion and the Heme-Binding Pocket. Journal of Chemical Information and Modeling. 2022
  • Yuka Kimura, Yusuke Kanematsu, Hiroki Sakagami, David S Rivera Rocabado, Tomomi Shimazaki, Masanori Tachikawa, Takayoshi Ishimoto. Hydrogen/Deuterium Transfer from Anisole to Methoxy Radicals: A Theoretical Study of a Deuterium-Labeled Drug Model. The journal of physical chemistry. A. 2022. 126. 1. 155-163
  • Takayoshi Ishimoto, Hiroki Sakagami, Yusuke Kanematsu, Masanori Tachikawa. H/D isotope effect between adsorbed water (H2O, D2O, and HDO) and H2O-and D2O-ice Ih(0001) basal surfaces based on the combined plane wave and localized basis set method. APPLIED SURFACE SCIENCE. 2021. 561
more...
MISC (2):
  • 加藤浩之, 上田顕, 藤野智子, 兼松佑典, 山田剛司, 立川仁典, 吉信淳, 森初果. Radical Self-Induction in a Proton-Donor/Acceptor Bilayer. 分子科学討論会講演プログラム&要旨(Web). 2021. 15th
  • 山本魁知, 兼松佑典, 長嶋雲兵, 上田顕, 森初果, 立川仁典. 水素結合型有機伝導体κ-H<sub>3</sub>(Cat-EDT-ST)<sub>2</sub>におけるH/D同位体効果の理論的解析. 分子科学討論会講演プログラム&要旨(Web). 2016. 10th
Education (3):
  • 2011 - 2014 Yokohama City University Graduate School of Nanobioscience Department of Nanosystem Science
  • 2009 - 2011 Nagoya University Graduate School of Information Science Department of Complex Systems Science
  • 2005 - 2009 Nagoya University School of Science Department of Chemistry
Work history (5):
  • 2020/10/01 - Hiroshima University Graduate School of Advanced Science and Engineering Assistant professor
  • 2020/04/01 - 2020/09/30 Hiroshima University Graduate School of Advanced Science and Engineering Researcher
  • 2017/04 - 2020/03 Hiroshima City University Special Postdoctoral Researcher
  • 2015/01 - 2015/05 Yokohama City University
  • 2014/09 - 2014/12 Yokohama City University
※ Researcher’s information displayed in J-GLOBAL is based on the information registered in researchmap. For details, see here.

Return to Previous Page