Affiliation | Graduate School of Engineering, Kyoto University | |
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Position | Associate Professor | |
Contact | ||
HP | http://www.riron.moleng.kyoto-u.ac.jp/index_en.html | |
Speciality | Theoretical Chemistry | |
Keyword | Hybrid Catalysis, Theoretical Calculation, Molecular Simulation, Mixed Solvent, Transition State Analysis, Reaction Environment | |
Institute | Chemical Society of Japan, American Chemical Society, Japan Society for Molecular Science, The Biophysical Society of Japan, Japan Society of Theoretical Chemistry |
Abstract
◆Project:
Theoretical Investigation of Molecular Mechanism of Hybrid Catalysis Focusing on Reaction Environment
Achievement
Original papers
- "Identification of a Self-Photosensitizing Hydrogen Atom Transfer Organocatalyst System"
Hiromu Fuse, Yu Irie, Masaaki Fuki, Yasuhiro Kobori, Kosaku Kato, Akira Yamakata, Masahiro Higashi, *Harunobu Mitsunuma, *Motomu Kanai
J. Am. Chem. Soc., 3/31/2022 - "Theoretical Study of the Mechanism of the Solvent Dependency of ESIPT in HBT"
Naka, K.; Sato, H.; *Higashi, M.
Phys. Chem. Chem. Phys., 7/19/2021, 23, 20080-20085 - "Theoretical Study on Isomerization of α-Acids: A DFT Calculation"
Kimura, M.; Ito, T.; Sato, H.; *Higashi, M.
Food Chem., 6/23/2021, 364, 130418 (6 pages) - "An Analysis of Valence Electronic Structure from a Viewpoint of Resonance Theory: Tautomerization of Formamide and Diazadiboretidine"
Nakatani, K.; Higashi, M.; Fukuda, R.; *Sato, H.
J. Comput. Chem., 5/27/2021, 42, 1662-1669 - "A Theoretical Study of Product Selectivity in Rhodium-Catalyzed Oxidative Coupling Reaction Caused by the Solvation Effect"
*Higashi, M.; Shibata, N.; Takeno, S.; Satoh, T.; Miura, M.; *Sato, H.
Heterocyc., 2/22/2021, 103, 952-964 - "Nuclear Magnetic Shielding of Molecule in Solution Based on Reference Interaction Site Model Self-Consistent Field with Spatial Electron Density Distribution"
Imamura, K.; Yamazaki, T.; Yokogawa, D.; Higashi, M.; *Sato, H.
J. Phys. Chem., 5/18/2020, 152, 194102 (11 pages) - "Site-Dependent Fluctuations Optimize Electronic Energy Transfer in the Fenna−Matthews−Olson Protein"
*Saito, S.; Higashi, M.; Fleming, G. R.
J. Phys. Chem. B, 10/28/2019, 123, 9762-9772 - "Effects of Water Addition on a Catalytic Fluorination of Dienamine"
Kuraoku, D.; Yonamine, T.; Koja, G.; Yoshida, N.; *Arimitsu, S.; *Higashi, M.
Molecules, 9/21/2019, 24, 3428 (8 pages) - "Kabirimine, a New Cyclic Imine from an Okinawan Dinoflagellate"
Hermawan, I.; Higa, M.; Hutabarat, P. U. B.; Fujiwara, T.; Akiyama, K.; Kanamoto, A.; Haruyama, T.; Kobayashi, N.; Higashi, M.; Suda, S.; *Tanaka, J.
Mar. Drugs, 6/13/2019, 17, 353 (9 pages) - "Vibrational and Molecular Properties of Mg2+ Binding and Ion Selectivity in the Magnesium Channel MgtE"
Kimura, T.; Lorenz-Fonfria, V. A.; Douki, S.; Motoki, H.; Ishitani, R.; Nureki, O.; Higashi, M.; *Furutani, Y.
J. Phys. Chem. B, 9/25/2018, 122, 9681-9696 - "Intramolecular Vibrations Complement the Robustness of Primary Charge Separation in a Dimer Model of the Photosystem II Reaction Center"
Fujihashi, Y.; Higashi, M.; *Ishizaki, A.
J. Phys. Chem. Lett., 8/10/2018, 9, 4921-4929
Review
- 「Importance of C–H Hydrogen Bonding in Asymmetric Catalysis」 *Arimitsu, S.; *Higashi, M., Noncovalent Interactions in Catalysis , 26-65, 3/18/2019