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J-GLOBAL ID：201701018613453633   Update date: Apr. 22, 2024

Hori Yuta

ホリ ユウタ | Hori Yuta
Affiliation and department：
University of Tsukuba Center for Computational Sciences

About University of Tsukuba Center for Computational Sciences


Job title： Assistant Professor
Research field  (1)： Basic physical chemistry
Research keywords  (3)： Theoretical Chemistry ,  Quantum Chemistry ,  Computational Chemistry
Research theme for competitive and other funds  (13)：
  • 2024 - 2027 Amino acid homochirality formation mechanism based on elementary processes in gas and solid phases
  • 2024 - 2025 Exploration of precise protein engineering through the fusion of synthetic chemistry and theoretical calculation
  • 2024 - 2025 無水プロトン伝導物質の伝導機構の理解に基づく物質設計
  • 2024 - 2025 電子共役プロトン移動反応のための電子状態解析
  • 2023 - 2024 Elucidation of Anhydrous Hydrogen Ion Conduction Process Mechanism by Theoretical Chemistry and Theoretical Proposal for Materials Design
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Papers (39)：
  • Ida, Tomonori, Kojima, Honoka, Hori, Yuta. Predicting and analyzing organic reaction pathways by combining machine learning and reaction network approaches. CHEMICAL COMMUNICATIONS. 2023. 59. 83. 12439-12442
  • Takumi Nakanishi, Yuta Hori, Yasuteru Shigeta, Hiroyasu Sato, Ryoji Kiyanagi, Koji Munakata, Takashi Ohhara, Atsushi Okazawa, Rintaro Shimada, Akira Sakamoto, et al. Development of an Iron(II) Complex Exhibiting Thermal- and Photoinduced Double Proton-Transfer-Coupled Spin Transition in a Short Hydrogen Bond. Journal of the American Chemical Society. 2023
  • Kawabe, Yusuke, Ito, Yoshikazu, Hori, Yuta, Kukunuri, Suresh, Shiokawa, Fumiya, Nishiuchi, Tomohiko, Jeong, Samuel, Katagiri, Kosuke, Xi, Zeyu, Li, Zhikai, et al. 1T/1H-SnS2 Sheets for Electrochemical CO2 Reduction to Formate. ACS nano. 2023. 17. 12. 11318-11326
  • Munei, Yohei, Hengphasatporn, Kowi, Hori, Yuta, Harada, Ryuhei, Shigeta, Yasuteru. Determination of the Association between Mesotrione Sensitivity and Conformational Change of 4-Hydroxyphenylpyruvate Dioxygenase via Free-Energy Analyses. Journal of agricultural and food chemistry. 2023. 71. 24. 9528-9537
  • Watanabe, Natsuki, Shoji, Mitsuo, Miyagawa, Koichi, Hori, Yuta, Boero, Mauro, Umemura, Masayuki, Shigeta, Yasuteru. Enantioselective Amino Acid interactions in Solution. PHYSICAL CHEMISTRY CHEMICAL PHYSICS. 2023. 25. 21. 15023-15029
ｍore...
MISC (6)：
  • 西岡海人, 出倉駿, 出倉駿, 出倉駿, 堀優太, 重田育照, 森初果. Elucidation of mechanism of anhydrous superprotonic conductivity in 1,2,3-triazolium dihydrogen phosphate single crystal by first-principles calculation. 分子科学討論会講演プログラム&要旨(Web). 2023. 17th
  • 小倉浩樹, 出倉駿, 堀優太, 重田育照, 水野元博, 水野元博, 森初果. Crystal structures and anhydrous proton conductivities of imidazolium and 1,2,4-triazolium methanesulfonates. 日本物理学会講演概要集(CD-ROM). 2023. 78. 1
  • 堀優太, 出倉駿, 井田朋智, 水野元博, 森初果, 重田育照. Proton conduction mechanism for anhydrous imidazolium hydrogen succinate investigated by quantum chemical calculation. 日本化学会春季年会講演予稿集(Web). 2022. 102nd
  • 西岡海人, 出倉駿, 堀優太, 重田育照, 水野元博, 水野元博, 熊井玲児, 森初果. Elucidation of superprotonic conduction mechanism by tautomerism in 1,2,3-triazolium dihydrogen phosphate single crystal. 日本物理学会講演概要集(CD-ROM). 2022. 77. 1
  • 堀優太, 出倉駿, 井田朋智, 水野元博, 水野元博, 森初果, 重田育照. Theoretical analysis of proton conduction mechanism for anhydrous imidazolium hydrogen succinate. 分子科学討論会講演プログラム&要旨(Web). 2021. 15th
ｍore...
Books (3)：
  • Hydrogenomics: The Science of Fully Utilizing Hydrogen
    共立出版 2023
  • Direct Hydroxylation of Methane: Interplay Between Theory and Experiment
    Springer 2020 ISBN:9789811569869
  • 高機能性金属錯体が拓く触媒科学:革新的分子変換反応の創出をめざして
    2020 ISBN:9784759813975
Lectures and oral presentations  (73)：
  • コンピュータ上でタンパク質や生体分子を操る
    (2024年度 一般公開:スーパーコンピュータ「Cygnus」を見に行こう!)
  • Theoretical Analysis of Structure, Electronic State, and Function of Metalloproteins by Computational Approach
    (凝縮系の理論化学)
  • SOD1のCYS酸化に伴う構造変化の理論的研究
    (日本コンピュータ化学会2023年)
  • Theoretical investigation into the electronic and geometrical structures for the oxidation tolerance of [NiFe]-hydrogenases
    (第61回日本生物物理学会年会)
  • 無水プロトン伝導物質の設計に向けた計算化学による伝導機構の理論解析
    (マテリアル・計測ハイブリッド研究センター若手フォーラム)
ｍore...
Professional career (1)：
  • 博士(理学) (金沢大学)
Work history (3)：
  • 2019/04 - 現在 University of Tsukuba Center for Computational Sciences Assistant Professor
  • 2018/04 - 2019/03 Kyushu University Institute for Materials Chemistry and Engineering
  • 2017/04 - 2018/03 Kyushu University Institute for Materials Chemistry and Engineering
Committee career (3)：
  • 2023/10 - 現在 理論化学会 第26回理論化学討論会 実行委員
  • 2021/01 - 2022/12 日本生物物理学会 分野別専門委員
  • 2021/08 - 2021/11 日本コンピュータ化学会 日本コンピュータ化学会2021年秋季年会 実行委員
Awards (4)：
  • 2022/05 - 2nd International Symposium “Hydrogenomics” Best Poster Award 2022
  • 2020/12 - 量子生命科学会 量子生命科学会 第二回大会 優秀発表賞
  • 2017/03 - 金沢大学 金沢大学大学院自然科学研究科長賞
  • 2012/03 - 金沢大学 金沢大学理工学域長賞
Association Membership(s) (8)：
PROTEIN SCIENCE SOCIETY OF JAPAN ,  Hydrogenomics alliance ,  量子生命科学会 ,  THE PHYSICAL SOCIETY OF JAPAN ,  THE BIOPHYSICAL SOCIETY OF JAPAN ,  Japan Society of Theoretical Chemistry ,  THE CHEMICAL SOCIETY OF JAPAN ,  Japan Society for Molecular Science
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