Research theme for competitive and other funds (19):
2024 - 2028 Investigation of molecular aggregation control mechanism by solution environment and creation of molecular design tools
2022 - 2025 動的溶液科学の推進
2022 - 2025 Theoretical study of self-condensation process of intrinsically disordered proteins in dynamic solution environment
2022 - 2025 アミロイド触媒型の原始酵素モデルに着想した人工酵素のデザインと応用
2019 - 2023 Development of electron transfer dynamics theory of biological systems highly incorporating solvent response
2016 - 2020 Statistical mechanics study on higher-order structure formation of proteins driven by water and ions
2015 - 2019 Fusion and development of multiconfigurational electronic state theory and integral equation theory suitable for quasidegenerate systems in solution
2016 - 2018 構造と環境の柔らかさが相関した光駆動イオン輸送の解明
2014 - 2016 チャネルロドプシンのイオン輸送の理論化学
2013 - 2016 Theoretical study on the charge transfer through DNA induced by structural and solvent fluctuation
2010 - 2014 Statistical Mechanics Theory of Ion Channel
2010 - 2014 Theoretical study of solvent effect on charge transfer of DNA
2011 - 2013 液体の統計力学と量子力学に基づくATP加水分解の自由エネルギー解析
2011 - 2013 Development of multiconfigurational electronic structure theory and simulation method for quasidegenerate systems in solution
2008 - 2012 Theoretical Study on Conjugated Dynamics of Protein and Solvent
2009 - 2010 DNAの電気伝導性と構造揺らぎに関する理論的研究
2003 - 2007 生体内化学過程の統計力学理論
液体の統計力学理論に立脚した溶液内化学・生物過程に関する理論的研究
Theoretical study of chemical and biological processes in solution by means of statistical mechanics of molecular liquids
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Papers (109):
Lian Duan, Kowit Hengphasatporn, Takahiro Sakai, Ryo Fujiki, Norio Yoshida, Shun Hirota, Yasuteru Shigeta. Why is Dimeric 3D Domain Swapping in Antibody Light Chains Missing from the Solution? Atomistic Insights Mechanisms. The Journal of Physical Chemistry B. 2024
Yutaka Maruyama, Norio Yoshida. RISMiCal: A software package to perform fast RISM/3D-RISM calculations. Journal of Computational Chemistry. 2024
Yuichiro Yoshida, Wataru Mizukami, Norio Yoshida. Solvent Distribution Effects on Quantum Chemical Calculations with Quantum Computers. Journal of Chemical Theory and Computation. 2024
Tsuyoshi Yamaguchi, Song-Ho Chong, Norio Yoshida. Coexistence of two coacervate phases of polyglycine in water suggested by polymer reference interaction site model theory. The Journal of Chemical Physics. 2023
Ryo Fujiki, Toru Matsui, Yasuteru Shigeta, Norio Yoshida, Haruyuki Nakano. Assessment of the applicability of the LFC/3D-RISM-SCF scheme for pKa prediction in methanol solutions. Chemistry Letters. 2023. 53. 1
Koki Makabe, Hideki Fujiwara, Kenta Hongo, Yuki Hori, Norio Yoshida. CAPTURING THE STRUCTURAL FLEXIBILITY OF SINGLE-LAYER BETA-SHEET WITHIN ISOMORPHOUS CRYSTALS REVEALED BY COMPREHENSIVE STRUCTURE DETERMINATIONS. PROTEIN SCIENCE. 2019. 28. 160-161
N. Ruankaew, N. Yoshida, S. Phongphanphanee. Solvated lithium ions in defective Prussian blue. IOP Conference Series: Materials Science and Engineering. 2019. 526
Norio Yoshida, Fumio Hirata. Statistical mechanical integral equation approach to reveal the solvation effect on hydrolysis free energy of ATP and its analogue. The Role of Water in ATP Hydrolysis Energy Transduction by Protein Machinery. 2018. 69-85
Shoichi Tanimoto, Norio Yoshida, Haruyuki Nakano. Effect of the distributed partial wave expansion on the solvation free energy in the 3D-RISM theory. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY. 2018. 255
Norio Yoshida, Yasuomi Kiyota, Thanyada Rungrotmongkol, Saree Phongphanphanee, Takashi Imai, Fumio Hirata. Statistical-mechanics theory of molecular recognition: Water and other molecules recognized by protein. Water: The Forgotten Biological Molecule. 2016. 63-87