Yoshida Norio 吉田紀生

… Alternative Names

YOSHIDA Norio 吉田紀生

吉田紀生ヨシダノリオ

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Researcher Number	10390650
Other IDs	https://orcid.org/0000-0002-2023-7254
Affiliation (Current)	2024: 名古屋大学, 情報学研究科, 教授
Affiliation (based on the past Project Information) *help	2022 – 2024: 名古屋大学, 情報学研究科, 教授 2017 – 2021: 九州大学, 理学研究院, 准教授 2013 – 2016: 九州大学, 高等研究院, 准教授 2015: 九州大学, 学内共同利用施設等, 准教授 2013: 九州大学, 学内共同利用施設等, 准教授 … More 2012 – 2013: 九州大学, 理学(系)研究科(院), 准教授 2012: 九州大学, 理学(系)研究科(研究院), 准教授 2009 – 2011: Institute for Molecular Science, 理論・計算分子科学研究領域, 助教 2007: 分子科学研究所, 理論・計算分子科学研究領域, 助教 2005 – 2006: 分子科学研究所, 理論分子科学研究系, 特別協力研究員 Less
Review Section/Research Field	Principal Investigator Science and Engineering / Basic Section 32010:Fundamental physical chemistry-related / Transformative Research Areas, Section (III) / Biological physics/Chemical physics/Soft matter physics / Physical chemistry / Complex systems / Biophysics/Chemical physics Except Principal Investigator Physical chemistry / Basic Section 27040:Biofunction and bioprocess engineering-related / Medium-sized Section 18:Mechanics of materials, production engineering, design engineering, and related fields / Transformative Research Areas, Section (III) / Science and Engineering / Science and Engineering
Keywords	Principal Investigator 理論化学 / 3D-RISM / DNA / 液体の積分方程式理論 / MDシミュレーション / ３D-RISM / 統計力学 / 電子移動 / ３Ｄ－ＲＩＳＭ / ３D-RISM-SCF … More / 電荷移動 / QM/MM / 溶媒効果 / 構造揺らぎ / 3D-RISM-SCF / モンテカルロ法 / 分子シミュレーション / 超分子ゲル / 酸化還元 / 動的密度汎関数法 / 相分離 / ハイブリッドモンテカルロ法 / ATP / 自己凝集 / 天然変性タンパク質 / 高分子RISM / 溶媒和ダイナミックス理論 / 分極応答理論 / 溶媒和ダイナミックス / エネルギー移動 / 積分方程式理論 / シトクロームC / 多量体形成 / ドメインスワッピング / チャネル / ロドプシン / 光駆動チャネル / 化学物理 / イオンチャネル / チャネルロドプシン / 線形応答理論 / 3D-RISM理論 / フラグメント分子軌道法 / ＦＭＯ / QM/MM/RISM / RISM-SCF / 自由エネルギー / ATP加水分解 / ピロリン酸 / DFT／３D-RISM / 正孔移動 / 電気伝導 … More Except Principal Investigator 3D-RISM理論 / 分子認識 / 蛋白質の揺らぎ / ダイナミクス / 3D-RISM / 分散・共分散行列 / 一般化ランジェヴァン理論 / RISM理論 / イオンチャネル / リガンド / 蛋白質 / アクアポリン / βシート / 人工酵素 / アミロイド / 蛋白質工学 / アミロイド触媒 / 計算科学 / 機械要素 / トライボロジー / アミロイド線維化 / 液-液相分離 / 動的溶液環境 / アミロイド線維 / 天然変性タンパク質 / 非膜型オルガネラ / 液液相分離 / シミュレーション手法 / 多配置電子状態炉論 / 相対論的電子状態理論 / シミュレーション技法 / 多配置電子状態理論 / 擬縮退系 / 理論化学 / 分子シミュレーション / GlpF / 平均力ポテンシャル / グリセリン / KcsAチャネル / 一般化ランジェヴァン方程式 / イオン選択性 / イオン分布 / イオンの選択性 / イオンの透過機構 / 蛋白質の構造揺らぎ / イオン透過機構 / カリウムチャネル / 揺らぎ / 生体機能 / プロトン透過 / M2チャネル / 鳥インフルエンザウイルス / 薬剤設計 / 熱力学積分法 / オーダーパラメタ / 構造揺らぎ / 自由エネルギー計算 / Phospholipase A2 / アスピリン / 創薬 / タンパク質の揺らぎ / 化合物スクリーニング / 蛋白質構造揺らぎ / 化合物スクリーニンク / 知的創薬 / 自由エネルギー / 蛋白質構造揺らき / 3D-RISM/RISM / 回転緩和 / N,N-deimethylaniline / 再配置エネルギー / 電子移動反応 / 圧力効果 / 部分モル圧縮率 / 部分モル体積 / 3次元RISM / 酵素反応 / リゾチーム / イオン / プロトン / 水分子 Less

Investigation of molecular aggregation control mechanism by solution environment and creation of molecular design toolsPrincipal Investigator
- Principal Investigator
  
  吉田紀生
- Project Period (FY)
  2024 – 2027
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Review Section
  
  Basic Section 32010:Fundamental physical chemistry-related
- Research Institution
  Nagoya University
Optimal Molecular Design of Polymeric Organic Friction Modifiers: A Computational Scheme Linking Molecular Structure to Macroscopic Frictional Properties
- Principal Investigator
  
  張賀東
- Project Period (FY)
  2024 – 2027
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Review Section
  
  Medium-sized Section 18:Mechanics of materials, production engineering, design engineering, and related fields
- Research Institution
  Nagoya University
動的溶液科学の推進
- Principal Investigator
  
  関山直孝
- Project Period (FY)
  2022 – 2024
- Research Category
  
  Grant-in-Aid for Transformative Research Areas (B)
- Review Section
  
  Transformative Research Areas, Section (III)
- Research Institution
  Kyoto University
Theoretical study of self-condensation process of intrinsically disordered proteins in dynamic solution environmentPrincipal Investigator
- Principal Investigator
  
  吉田紀生
- Project Period (FY)
  2022 – 2024
- Research Category
  
  Grant-in-Aid for Transformative Research Areas (B)
- Review Section
  
  Transformative Research Areas, Section (III)
- Research Institution
  Nagoya University
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
- Principal Investigator
  
  眞壁幸樹 (真壁幸樹)
- Project Period (FY)
  2022 – 2024
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Review Section
  
  Basic Section 27040:Biofunction and bioprocess engineering-related
- Research Institution
  Yamagata University
Development of electron transfer dynamics theory of biological systems highly incorporating solvent responsePrincipal Investigator
- Principal Investigator
  
  Yoshida Norio
- Project Period (FY)
  2019 – 2022
- Research Category
  
  Grant-in-Aid for Scientific Research (B)
- Review Section
  
  Basic Section 32010:Fundamental physical chemistry-related
- Research Institution
  Nagoya University
  Kyushu University
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Principal Investigator
- Principal Investigator
  
  吉田紀生
- Project Period (FY)
  2016 – 2017
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Science and Engineering
- Research Institution
  Kyushu University
Statistical mechanics study on higher-order structure formation of proteins driven by water and ionsPrincipal Investigator
- Principal Investigator
  
  Yoshida Norio
- Project Period (FY)
  2016 – 2019
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Biological physics/Chemical physics/Soft matter physics
- Research Institution
  Kyushu University
チャネルロドプシンのイオン輸送の理論化学Principal Investigator
- Principal Investigator
  
  吉田紀生
- Project Period (FY)
  2014 – 2015
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Science and Engineering
- Research Institution
  Kyushu University
Theoretical study on the charge transfer through DNA induced by structural and solvent fluctuationPrincipal Investigator
- Principal Investigator
  
  YOSHIDA NORIO
- Project Period (FY)
  2013 – 2015
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Physical chemistry
- Research Institution
  Kyushu University
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Principal Investigator
- Principal Investigator
  
  吉田紀生
- Project Period (FY)
  2011 – 2012
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Complex systems
- Research Institution
  Kyushu University
  Institute for Molecular Science
Development of multiconfigurational electronic structure theory and simulation method for quasidegenerate systems in solution
- Principal Investigator
  
  NAKANO Haruyuki
- Project Period (FY)
  2011 – 2013
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Physical chemistry
- Research Institution
  Kyushu University
Statistical Mechanics Theory of Ion Channel
- Principal Investigator
  
  HIRATA Fumio
- Project Period (FY)
  2010 – 2013
- Research Category
  
  Grant-in-Aid for Scientific Research (A)
- Research Field
  
  Physical chemistry
- Research Institution
  Ritsumeikan University
  Institute for Molecular Science
Theoretical study of solvent effect on charge transfer of DNAPrincipal Investigator
- Principal Investigator
  
  YOSHIDA Norio
- Project Period (FY)
  2010 – 2013
- Research Category
  
  Grant-in-Aid for Young Scientists (B)
- Research Field
  
  Biophysics/Chemical physics
- Research Institution
  Kyushu University
  Institute for Molecular Science
DNAの電気伝導性と構造揺らぎに関する理論的研究Principal Investigator
- Principal Investigator
  
  吉田紀生
- Project Period (FY)
  2009 – 2010
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Science and Engineering
- Research Institution
  Institute for Molecular Science
Theoretical Study on Conjugated Dynamics of Protein and Solvent
- Principal Investigator
  
  HIRATA Fumio
- Project Period (FY)
  2008 – 2012
- Research Category
  
  Grant-in-Aid for Scientific Research on Innovative Areas (Research in a proposed research area)
- Review Section
  
  Science and Engineering
- Research Institution
  Ritsumeikan University
  Institute for Molecular Science
生体内化学過程の統計力学理論
- Principal Investigator
  
  HIRATA Fumio
- Project Period (FY)
  2003 – 2007
- Research Category
  
  Grant-in-Aid for Scientific Research on Priority Areas
- Review Section
  
  Science and Engineering
- Research Institution
  Institute for Molecular Science
  Okazaki National Research Institutes

[Book] Molecular Aspects of Solvation Investigated using Statistical Mechanics, in Leszczynski (Ed.): "Handbook of Computational Chemistry", 2nd edn2016
- Author(s)
  Norio Yoshida, Katsura Nishiyama
- Total Pages
  17
- Publisher
  Springer Science
- Data Source
  KAKENHI-PROJECT-16K05519
[Book] "Theory of Molecular Recognition and Structural Fluctuation of Biomolecules", in Terazima et al.(Ed.) "Molecular Science of Fluctuations Toward Biological Functions", Chapter 82016
- Author(s)
  Fumio Hirata, Norio Yoshida, Bongsoo Kim
- Total Pages
  19
- Publisher
  Springer Science
- Data Source
  KAKENHI-PROJECT-25410021
[Book] "Molecular Aspects of Solvation Investigated using Statistical Mechanics", in Leszczynski (Ed.) "Handbook of Computational Chemistry", 2nd edn2016
- Author(s)
  Norio Yoshida, Katsura Nishiyama
- Total Pages
  17
- Publisher
  Springer Science
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Book] 「水と生体分子のハーモニー」。日本化学会編「巨大分子系の計算科学」第15章2012
- Author(s)
  吉田紀生、丸山豊、清田泰臣、平田文男、今井隆志
- Publisher
  化学同人
- Data Source
  KAKENHI-PROJECT-22245002
[Book] "水と生体分子のハーモニー", 巨大分子系の計算化学超大型計算機時代の理論化学の新展開15章2012
- Author(s)
  吉田紀生, 丸山豊, 清田泰臣, 平田文男, 今井隆志
- Publisher
  日本化学会編
- Data Source
  KAKENHI-PROJECT-22740279
[Book] 巨大分子系の統計力学2012
- Author(s)
  吉田紀生
- Total Pages
  12
- Publisher
  化学同人
- Data Source
  KAKENHI-PLANNED-20107008
[Book] 「水と生体分子のハーモニー」。日本化学会編「巨大分子系の計算科学」第15章2012
- Author(s)
  吉田紀生、丸山豊、清田泰臣、平田文男、今井隆志
- Publisher
  化学同人
- Data Source
  KAKENHI-PLANNED-20107008
[Book] 巨大分子系の統計力学2012
- Author(s)
  吉田紀生
- Total Pages
  12
- Publisher
  化学同人
- Data Source
  KAKENHI-PROJECT-22245002
[Book] Chapter 4 in Bihan and Fukuyama(Ed.) : "Water, the forgotten biological molecule."2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Thanyada Rungrotmongkol, Saree Phongphanphanee, Takashi Imai, Fumio Hirata
- Total Pages
  24
- Publisher
  Pan Stanford Publishing
- Data Source
  KAKENHI-PUBLICLY-21107529
[Book] Chapter 4 in Bihan and Fukuyama(Ed.) : "Water, the forgotten biological molecule."2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Thanyada Rungrotmongkol, Saree Phongphanphanee, Takashi Imai, Fumio Hirata
- Total Pages
  24
- Publisher
  Pan Stanford Publishing
- Data Source
  KAKENHI-PROJECT-22740279
[Book] Chapter 4 in Bihan and Fukuyama (Ed.) : "Water, the forgotten biological molecule."2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Thanyada Rungrotmongkol, Saree Phongphanphanee, Takashi Imai, Fumio Hirata
- Total Pages
  24
- Publisher
  Pan Stanford Publishing
- Data Source
  KAKENHI-PROJECT-22245002
[Book] Chapter 4 in Bihan and Fukuyama(Ed.) : "Water, the forgotten biological molecule."2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Thanyada Rungrotmongkol, Saree Phongphanphanee, Takashi Imai, Fumio Hirata
- Total Pages
  24
- Publisher
  Pan Stanford Publishing
- Data Source
  KAKENHI-PLANNED-20107008
[Book] 「分子認識とイオンチャネルの統計力学理論」、「揺らぎと生体機能」第01-3章2010
- Author(s)
  平田文男、吉田紀生、Saree Phongphanphanee
- Publisher
  Medical Bio, オーム社
- Data Source
  KAKENHI-PROJECT-22245002
[Book] Model-Free "Solvent Modeling" in Chemistry and Biochemistry Based on the Statistical Mechanics of Liquids, in Feig(Ed.) : "Modeling Solvent Environ ments."2010
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Yasuhiro Ikuta, Takashi Imai, Ffumio Hirata
- Total Pages
  24
- Publisher
  Willy-VCH
- Data Source
  KAKENHI-PLANNED-20107008
[Book] Water, theforgottenbiologicalmolecule(Statistical-mechanics theory of molecular recognition : water and other molecules recognized by protein)(in Bihan and Fukuyama(Ed.))(Chapter 4)2010
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Saree Phongphanphanee, Takashi Imai, Fumio Hirata
- Publisher
  Pan Stanford Publishing
- Data Source
  KAKENHI-PLANNED-20107008
[Book] Statistical-mechanics theory of molecular recognition: water and other molecules recognized by protein, in Bihan and Fukuyama(Ed.): "Water, the forgotten biological molecule."2010
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Saree Phongphanphanee, Takashi Imai and Fumio Hirata
- Publisher
  Pan Stanford Publishing, Singapore
- Data Source
  KAKENHI-PLANNED-20107008
[Book] "分子認識とイオンチャネルの統計力学理論",Medical Bio 10月別冊揺らぎと生体機能、寺嶋正秀監修2010
- Author(s)
  平田文男、吉田紀生、Saree Phongphanphanee
- Total Pages
  6
- Publisher
  オーム社
- Data Source
  KAKENHI-PLANNED-20107008
[Book] Model-Free "Solvent Modeling" in Chemistry and Biochemistry Based on the Statistical Mechanics of Liquids, in Feig(Ed.) : "Modeling Solvent Environments."2010
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Yasuhiro Ikuta, Takashi Imai, Fumio Hirata
- Total Pages
  24
- Publisher
  Willy-VCH
- Data Source
  KAKENHI-PUBLICLY-21107529
[Book] 揺らぎと生体機能(別冊・メディカルバイオ)(Statistical Mechanics theory of molecular recognition and ion channels)2010
- Author(s)
  平田文男, 吉田紀生
- Publisher
  Saree Phonphanphanee
- Data Source
  KAKENHI-PLANNED-20107008
[Book] "分子認識とイオンチャネルの統計力学理論",Medical Bio 10月別冊揺らぎと生体機能(寺嶋正秀監修)2010
- Author(s)
  平田文男、吉田紀生、Saree Phongphanphanee
- Total Pages
  6
- Publisher
  オーム社
- Data Source
  KAKENHI-PROJECT-22245002
[Book] Statistical-mechanics theory of molecular recognition : water and other molecules recognized by protein, in Bihan and Fukuyama(Ed.): "Water, the forgotten biological molecule."2010
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Saree Phongphanphanee, Takashi Imai and Fumio Hirata
- Publisher
  Pan Stanford Publishing, Singapore
- Data Source
  KAKENHI-PROJECT-22245002
[Book] "A Statistical Mechanics Theory of Molecular Recognition," in "Water and Biomolecules," Eds, K. Kuwajima, Y. Goto, F. Hirata, M. Kataoka, and M, Terazima2009
- Author(s)
  T. Imai, N. Yoshida, A. Kovalenko, and F. Hirata
- Publisher
  Springer
- Data Source
  KAKENHI-PLANNED-20107008
[Book] A Statistical Mechanics Theory of Molecular Recognition, Chapter 10, in Water and Biomolecules - Physical Chemistry of Life Phenomena2009
- Author(s)
  Takashi Imai, Norio Yoshida, Andriy Kovalenko, Fumio Hirata
- Total Pages
  24
- Publisher
  Springer Science
- Data Source
  KAKENHI-PUBLICLY-21107529
[Book] "Model-Free "Solvent Modeling" in Chemistry and Biochemistry Based on the Statistical Mechanics of Liquids," in "Modeling Solvent Environment," Ed. M. Feig2009
- Author(s)
  N. Yoshida, Y. Kiyota, Y. Ikuta, T. Imai, and F. Hirata
- Publisher
  Wiley-VCH
- Data Source
  KAKENHI-PLANNED-20107008
[Book] A Statistical Mechanics Theory of Molecular Recognition, Chapter 10, in Water and Biomolecules - Physical Chemistry of Life Phenomena.2009
- Author(s)
  Takashi Imai, Norio Yoshida, Andriy Kovalenko, Fumio Hirata
- Total Pages
  24
- Publisher
  Springer Science
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] RISMiCal: A software package to perform fast RISM/3D‐RISM calculations2024
- Author(s)
  Maruyama Yutaka、Yoshida Norio
- Journal Title
  
  Journal of Computational Chemistry
  
  Volume: - Issue: 17 Pages: 1470-1482
- DOI
  10.1002/jcc.27340
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22H05089
[Journal Article] Solvent Distribution Effects on Quantum Chemical Calculations with Quantum Computers2024
- Author(s)
  Yoshida Yuichiro、Mizukami Wataru、Yoshida Norio
- Journal Title
  
  Journal of Chemical Theory and Computation
  
  Volume: 20 Issue: 5 Pages: 1962-1971
- DOI
  10.1021/acs.jctc.3c01189
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21K18933, KAKENHI-PLANNED-22H05089, KAKENHI-PLANNED-23H03819
[Journal Article] A method for protein structure sampling under three-dimensional reference interaction site model solvation based on hybrid Monte Carlo framework2023
- Author(s)
  Yoshida Norio、Yamaguchi Tsuyoshi
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: 385 Pages: 122418-122418
- DOI
  10.1016/j.molliq.2023.122418
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22H05089
[Journal Article] Theoretical Analysis of the Role of Water in Ligand Binding to Cucurbit[n]uril of Different Sizes2023
- Author(s)
  Chiangraeng Natthiti、Nakano Haruyuki、Nimmanpipug Piyarat、Yoshida Norio
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 127 Issue: 16 Pages: 3651-3662
- DOI
  10.1021/acs.jpcb.3c00343
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-21K04980, KAKENHI-PLANNED-22H05089, KAKENHI-PROJECT-19H02677
[Journal Article] Effects of intramolecular chain conformation on the hydration and miscibility of polyethylene glycol in water studied by means of polymer reference interaction site model theory2023
- Author(s)
  Yamaguchi Tsuyoshi、Chong Song-Ho、Yoshida Norio
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 159 Issue: 4 Pages: 044901-044901
- DOI
  10.1063/5.0159130
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22H05089
[Journal Article] Effects of angular momentum and thermostat on molecular dynamics simulation of single-chain conformation in an implicit solvent2023
- Author(s)
  Yamaguchi Tsuyoshi、Chong Song-Ho、Yoshida Norio
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: 385 Pages: 122311-122311
- DOI
  10.1016/j.molliq.2023.122311
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22H05089
[Journal Article] Tuning the ATP-ATP and ATP-disordered protein interactions in high ATP concentration by altering water models2023
- Author(s)
  Mori Toshifumi、Yoshida Norio
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 159 Issue: 3 Pages: 035102-035102
- DOI
  10.1063/5.0158046
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22H05089, KAKENHI-PROJECT-23K23303
[Journal Article] Assessment of the applicability of the LFC/3D-RISM-SCF scheme for pKa prediction in methanol solutions2023
- Author(s)
  Fujiki Ryo、Matsui Toru、Shigeta Yasuteru、Yoshida Norio、Nakano Haruyuki
- Journal Title
  
  Chemistry Letters
  
  Volume: 53 Issue: 1 Pages: 245101-245101
- DOI
  10.1093/chemle/upad009
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21K04980, KAKENHI-PLANNED-22H05089
[Journal Article] Selective molecular recognition of amino acids and their derivatives by cucurbiturils in aqueous solution: An MD/3D-RISM study2023
- Author(s)
  Chiangraeng Natthiti、Nakano Haruyuki、Nimmanpipug Piyarat、Yoshida Norio
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: 386 Pages: 122503-122503
- DOI
  10.1016/j.molliq.2023.122503
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-21K04980, KAKENHI-PLANNED-22H05089
[Journal Article] Coexistence of two coacervate phases of polyglycine in water suggested by polymer reference interaction site model theory2023
- Author(s)
  Yamaguchi Tsuyoshi、Chong Song-Ho、Yoshida Norio
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 159 Issue: 24 Pages: 245101-245101
- DOI
  10.1063/5.0185157
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22H05089
[Journal Article] Phase equilibrium of three-component liquid systems composed of water, alcohol, and sodium chloride studied by the reference interaction-site model integral equation theory2023
- Author(s)
  Yamaguchi Tsuyoshi、Chong Song-Ho、Yoshida Norio
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 158 Issue: 8 Pages: 084502-084502
- DOI
  10.1063/5.0142256
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22H05089, KAKENHI-PROJECT-19H02677
[Journal Article] Application of the reference interaction site model self-consistent field method based on the Dirac-Hartree-Fock wave function to a chemical reaction2023
- Author(s)
  Kanemaru K、Watanabe Y、Yoshida N、Nakano H
- Journal Title
  
  IOP Conference Series: Materials Science and Engineering
  
  Volume: 1280 Issue: 1 Pages: 012002-012002
- DOI
  10.1088/1757-899x/1280/1/012002
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21K04980, KAKENHI-PLANNED-22H05089, KAKENHI-PROJECT-19H02677
[Journal Article] Study of phase equilibria and thermodynamic properties of liquid mixtures using the integral equation theory: Application to water and alcohol mixtures2022
- Author(s)
  Yamaguchi Tsuyoshi、Chong Song-Ho、Yoshida Norio
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 157 Issue: 23 Pages: 234502-234502
- DOI
  10.1063/5.0131475
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-22H05089, KAKENHI-PROJECT-19H02677
[Journal Article] Solvent effects in four‐component relativistic electronic structure theory based on the reference interaction‐site model2022
- Author(s)
  Kanemaru Kodai、Watanabe Yoshihiro、Yoshida Norio、Nakano Haruyuki
- Journal Title
  
  Journal of Computational Chemistry
  
  Volume: 44 Issue: 1 Pages: 5-14
- DOI
  10.1002/jcc.27009
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-21K04980, KAKENHI-PLANNED-22H05089, KAKENHI-PROJECT-19H02677
[Journal Article] Implementation of solvent polarization in three-dimensional reference interaction-site model self-consistent field theory2022
- Author(s)
  Yoshida Norio、Yamaguchi Tsuyoshi、Nakano Haruyuki
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 797 Pages: 139579-139579
- DOI
  10.1016/j.cplett.2022.139579
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18K05036, KAKENHI-PROJECT-19H02677, KAKENHI-PROJECT-21K04980
[Journal Article] Solvation dynamics in electronically polarizable solvents: Theoretical treatment using solvent-polarizable three-dimensional reference interaction-site model theory combined with time-dependent density functional theory2021
- Author(s)
  Yamaguchi Tsuyoshi、Yoshida Norio
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 154 Issue: 4 Pages: 044504-044504
- DOI
  10.1063/5.0036289
- NAID
  120007169516
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19K03768, KAKENHI-PROJECT-19H02677
[Journal Article] A computational method to simulate global conformational changes of proteins induced by cosolvent2021
- Author(s)
  Tanimoto Shoichi、Tamura Koichi、Hayashi Shigehiko、Yoshida Norio、Nakano Haruyuki
- Journal Title
  
  Journal of Computational Chemistry
  
  Volume: 42 Issue: 8 Pages: 552-563
- DOI
  10.1002/jcc.26481
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18K05036, KAKENHI-PUBLICLY-20H05098, KAKENHI-PUBLICLY-20H05441, KAKENHI-PROJECT-19H03195, KAKENHI-PROJECT-19H02677
[Journal Article] Nonequilibrium free-energy profile of charge-transfer reaction in polarizable solvent studied using solvent-polarizable three-dimensional reference interaction-site model theory2020
- Author(s)
  Yamaguchi Tsuyoshi、Yoshida Norio
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 153 Issue: 3 Pages: 034502-034502
- DOI
  10.1063/5.0013083
- NAID
  120006948933
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19H02677
[Journal Article] Development of a solvent-polarizable three-dimensional reference interaction-site model theory2020
- Author(s)
  Yoshida Norio、Yamaguchi Tsuyoshi
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 152 Issue: 11 Pages: 114108-114108
- DOI
  10.1063/5.0004173
- NAID
  120006869620
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19H02677
[Journal Article] β-sheet elasticity of peptide self-assembly mimic, PSAM, with a graftedsequence characterized by comprehensive analyses ofisomorphous crystals2019
- Author(s)
  Hideki Fujiwara, Kenta Hongo, Yuki Hori, Norio Yoshida, *Koki Makabe
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: 290 Pages: 111161-111161
- DOI
  10.1016/j.molliq.2019.111161
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-16H06439, KAKENHI-PROJECT-19H02677
[Journal Article] Implementation of state-averaged MCSCF method to RISM- and 3D-RISM-SCF schemes2019
- Author(s)
  Okamoto Daisuke、Watanabe Yoshihiro、Yoshida Norio、Nakano Haruyuki
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 730 Pages: 179-185
- DOI
  10.1016/j.cplett.2019.05.051
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18K05036, KAKENHI-PROJECT-19H02677
[Journal Article] Effects of Water Addition on a Catalytic Fluorination of Dienamine2019
- Author(s)
  Kuraoku Daiki、Yonamine Tsunaki、Koja Genta、Yoshida Norio、Arimitsu Satoru、Higashi Masahiro
- Journal Title
  
  Molecules
  
  Volume: 24 Issue: 19 Pages: 3428-3428
- DOI
  10.3390/molecules24193428
- NAID
  120006800746
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16KT0165, KAKENHI-PROJECT-17K05757, KAKENHI-PUBLICLY-18H04657, KAKENHI-PROJECT-17K14451, KAKENHI-PROJECT-19H02677
[Journal Article] Three-Dimensional Reference Interaction Site Model Self-Consistent Field Study on the Coordination Structure and Excitation Spectra of Cu(II)-Water Complexes in Aqueous Solution2019
- Author(s)
  Yang Chen、Watanabe Yoshihiro、Yoshida Norio、Nakano Haruyuki
- Journal Title
  
  The Journal of Physical Chemistry A
  
  Volume: 未定 Issue: 15 Pages: 3344-3354
- DOI
  10.1021/acs.jpca.9b01364
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-15K05392, KAKENHI-PROJECT-16K05519, KAKENHI-PROJECT-18K05036, KAKENHI-PROJECT-19H02677
[Journal Article] Effect of Molecular Orientational Correlations on Solvation Free Energy Computed by Reference Interaction Site Model Theory2019
- Author(s)
  Tanimoto Shoichi、Yoshida Norio、Yamaguchi Tsuyoshi、Ten-no Seiichiro L.、Nakano Haruyuki
- Journal Title
  
  Journal of Chemical Information and Modeling
  
  Volume: 59 Issue: 9 Pages: 3770-3781
- DOI
  10.1021/acs.jcim.9b00330
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18K05036, KAKENHI-PROJECT-19J11525, KAKENHI-PROJECT-18H03900, KAKENHI-PROJECT-19H02677
[Journal Article] Relation between Anharmonicity of Free-Energy Profile and Spectroscopy in Solvation Dynamics: Differences in Spectral Broadening and Peak Shift in Transient Hole-Burning Spectroscopy Studied by Equilibrium Molecular Dynamics Simulation2019
- Author(s)
  Yamaguchi Tsuyoshi、Yoshida Norio、Nishiyama Katsura
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: 123 Issue: 32 Pages: 7036-7042
- DOI
  10.1021/acs.jpcb.9b04711
- NAID
  120006765143
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-19H02677
[Journal Article] Distinct ionic adsorption sites in defective Prussian blue: a 3D-RISM study2019
- Author(s)
  Ruankaew Nirun、Yoshida Norio、Watanabe Yoshihiro、Nakayama Akira、Nakano Haruyuki、Phongphanphanee Saree
- Journal Title
  
  Physical Chemistry Chemical Physics
  
  Volume: 21 Issue: 40 Pages: 22569-22576
- DOI
  10.1039/c9cp04355a
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-18K05036, KAKENHI-PROJECT-19H02677
[Journal Article] Role of Mg2+ ions in DNA hydrolysis by EcoRV, Studied by 3D-Rerefence interaction site model and molecular dynamics2018
- Author(s)
  Itaru Onishi, Shunya Sunaba, Norio Yoshida, Fumio Hirata, Masayuki Irisa
- Journal Title
  
  Journal of Physical Chemistry B
  
  Volume: 122 Issue: 39 Pages: 9061-9075
- DOI
  10.1021/acs.jpcb.7b12555
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05519
[Journal Article] Theoretical Study on Oligomerization of Cytochrome <i>c</i>2018
- Author(s)
  根木秀佳、吉田紀生、廣田俊、東雅大
- Journal Title
  
  J. Comput. Chem. Jpn.
  
  Volume: 17 Issue: 1 Pages: 8-13
- DOI
  10.2477/jccj.2018-0006
- NAID
  130006528632
- ISSN
  1347-1767, 1347-3824
- Language
  Japanese
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PUBLICLY-16H00778, KAKENHI-PUBLICLY-16H00839, KAKENHI-WRAPUP-18H05203, KAKENHI-PROJECT-16K05519
[Journal Article] Theoretical analysis of the domain-swapped dimerization of cytochrome c: An MD and 3D-RISM approach2018
- Author(s)
  Yoshida Norio、Higashi Masahiro、Motoki Hideyoshi、Hirota Shun
- Journal Title
  
  The Journal of Chemical Physics
  
  Volume: 148 Issue: 2 Pages: 025102-025102
- DOI
  10.1063/1.5009785
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16KT0165, KAKENHI-PROJECT-17K05757, KAKENHI-PUBLICLY-16H00778, KAKENHI-PUBLICLY-16H00839, KAKENHI-PROJECT-16K05519
[Journal Article] An Atomistic Model of a Precursor State of Light-Induced Channel Opening of Channelrhodopsin2018
- Author(s)
  Cheng Cheng, Motoshi Kamiya, Mizuki Takemoto, Ryuichiro Ishitani, Osamu Nureki, *Norio Yoshida, and *Shigehiko Hayashi
- Journal Title
  
  Biophysical Journal
  
  Volume: 115 Issue: 7 Pages: 1281-1291
- DOI
  10.1016/j.bpj.2018.08.024
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PUBLICLY-18H05161, KAKENHI-PROJECT-16H04776, KAKENHI-PROJECT-17H03640, KAKENHI-PROJECT-16J11404, KAKENHI-PROJECT-16K05519, KAKENHI-PROJECT-16H06294
[Journal Article] A computational scheme of pKa values based on the three-dimensional reference interaction site model self-consistent field theory coupled with the linear fitting correction scheme2018
- Author(s)
  Fujiki Ryo、Kasai Yukako、Seno Yuki、Matsui Toru、Shigeta Yasuteru、Yoshida Norio、Nakano Haruyuki
- Journal Title
  
  Physical Chemistry Chemical Physics
  
  Volume: 20 Issue: 43 Pages: 27272-27279
- DOI
  10.1039/c8cp04354j
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-18K05036, KAKENHI-PROJECT-15K05392, KAKENHI-PROJECT-16K05519
[Journal Article] A new method for finding the minimum free energy pathway of ions and small molecule transportation through protein based on 3D-RISM theory and the string method2018
- Author(s)
  Norio Yoshida
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 699 Pages: 22-27
- DOI
  10.1016/j.cplett.2018.03.034
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-16H00842, KAKENHI-PROJECT-16K05519
[Journal Article] Size-dependent adsorption sites in a Prussian blue nanoparticle: A 3D-RISM study2017
- Author(s)
  Nirun Ruankaew, Norio Yoshida, Yoshihiro Watanabe, Haruyuki Nakano, Saree Phongphanphanee
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 684 Pages: 117-125
- DOI
  10.1016/j.cplett.2017.06.053
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519, KAKENHI-PUBLICLY-16H00842, KAKENHI-INTERNATIONAL-15K21740
[Journal Article] Solvatochromism and Preferential Solvation of Brooker's Merocyanine in Water-Methanol Mixtures2017
- Author(s)
  Yuichi Tanaka, Yukio Kawashima, Norio Yoshida, Haruyuki Nakano
- Journal Title
  
  J. Comput. Chem.
  
  Volume: 38 Issue: 28 Pages: 2411-2419
- DOI
  10.1002/jcc.24902
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-15K05392, KAKENHI-PROJECT-16K05519, KAKENHI-PROJECT-16K05676, KAKENHI-PUBLICLY-16H00842, KAKENHI-PROJECT-26410030
[Journal Article] Role of Solvation in Drug Design as Revealed by the Statistical Mechanics Integral Equation Theory of Liquids2017
- Author(s)
  Norio Yoshida
- Journal Title
  
  Journal of Chemical Information and Modeling
  
  Volume: 57 Issue: 11 Pages: 2646-2656
- DOI
  10.1021/acs.jcim.7b00389
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05519, KAKENHI-PUBLICLY-16H00842
[Journal Article] A 3D-RISM/RISM study of the oseltamivir binding efficiency with the wild-type and resistance-associated mutant forms of the viral influenza B neuraminidase2016
- Author(s)
  Jiraphorn Phanich, Thanyada Rungrotmongkol, Daniel Sindhikara, Saree Phongphanphanee, Norio Yoshida, Fumio Hirata, Nawee Kungwan and Supot Hannongbua
- Journal Title
  
  Protein science
  
  Volume: 25 Issue: 1 Pages: 147-158
- DOI
  10.1002/pro.2718
- Peer Reviewed / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-26104526, KAKENHI-PROJECT-25410021
[Journal Article] Theoretical analysis of complex formation of　p-carboxybenzeneboronic acid with a monosaccharide2016
- Author(s)
  Yuki Seno, Norio Yoshida, Haruyuki Nakano
- Journal Title
  
  J. Mol. Liq.
  
  Volume: 印刷中 Pages: 93-98
- DOI
  10.1016/j.molliq.2015.12.063
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PROJECT-15K05392, KAKENHI-PUBLICLY-26104526, KAKENHI-PROJECT-25410021
[Journal Article] The ion-dependence of carbohydrate binding of CBM36: MD and 3D-RISM study2016
- Author(s)
  Shoichi Tanimoto, Masahiro Higashi, Norio Yoshida, Haruyuki Nakano
- Journal Title
  
  Journal of Physics: Condensed Matter
  
  Volume: 28 Issue: 34 Pages: 344005-344005
- DOI
  10.1088/0953-8984/28/34/344005
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PUBLICLY-16H00778, KAKENHI-PUBLICLY-16H00842, KAKENHI-PROJECT-26810008, KAKENHI-PROJECT-15K05392, KAKENHI-PROJECT-16K05519
[Journal Article] Three-Dimensional Reference Interaction Site Model Self-Consistent Field Analysis of Solvent and Substituent Effects on the Absorption Spectra of Brooker's Merocyanine2015
- Author(s)
  Yuichi Tanaka, Norio Yoshida, Haruyuki Nakano
- Journal Title
  
  J. Comput. Chem.
  
  Volume: 36 Issue: 22 Pages: 1655-1663
- DOI
  10.1002/jcc.23980
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PROJECT-15K05392, KAKENHI-PUBLICLY-26104526, KAKENHI-PROJECT-15J04698, KAKENHI-PROJECT-25410021
[Journal Article] 続・生物工学基礎講座　バイオよもやま話「生体分子の溶媒和理論」2015
- Author(s)
  吉田紀生
- Journal Title
  
  生物工学会誌
  
  Volume: 8 Pages: 481-486
- NAID
  110009985417
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-25410021
[Journal Article] Theoretical analysis of co-solvent effect on the proton transfer reaction of glycine in a water-acetonitrile mixture2015
- Author(s)
  Yukako Kasai, Norio Yoshida, Haruyuki Nakano
- Journal Title
  
  J. Chem. Phys.
  
  Volume: 142 Issue: 20
- DOI
  10.1063/1.4921432
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PROJECT-15K05392, KAKENHI-PUBLICLY-26104526
[Journal Article] 続・生物工学基礎講座　バイオよもやま話「生体分子の溶媒和理論」2015
- Author(s)
  吉田紀生
- Journal Title
  
  生物工学会誌
  
  Volume: 8 Pages: 481-486
- NAID
  110009985417
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-26104526
[Journal Article] 液体の統計力学理論によるチャネルタンパクの透過現象解析2014
- Author(s)
  吉田紀生
- Journal Title
  
  膜
  
  Volume: 39 Pages: 379-384
- NAID
  130005069453
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-25410021
[Journal Article] Distinct Configurations of Cations and Water in the Selective Filter of the KcsA Potasium Channel Probed by the 3D-RISM Theory2014
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Shigetoshi Oiki, and Fumio Hirata
- Journal Title
  
  J．Mol. Liq.
  
  Volume: 167 Pages: 578-584
- DOI
  10.1016/j.molliq.2014.03.050
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-23370067, KAKENHI-PROJECT-24659096, KAKENHI-PROJECT-25410021, KAKENHI-PUBLICLY-26102516, KAKENHI-PROJECT-26253014
[Journal Article] Massively Parallel Implementation of 3D-RISM Calculation with Volumetric 3D-FFT2014
- Author(s)
  Yutaka Maruyama, Norio Yoshida, Hiroto Tadano, Daisuke Takahashi, Mitsuhisa Takahashi, and Fumio Hirata
- Journal Title
  
  J. Comp. Chem
  
  Volume: 35巻 (印刷中) Issue: 18 Pages: 1347-1355
- DOI
  10.1002/jcc.23619
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Efficient implementation of the three-dimensional reference interaction site model method in the fragment molecular orbital method2014
- Author(s)
  Norio Yoshida
- Journal Title
  
  Journal of Chemical Physics
  
  Volume: 140 Issue: 21
- DOI
  10.1063/1.4879795
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PROJECT-25410021, KAKENHI-PUBLICLY-26104526
[Journal Article] Theoretical analysis of salt effect on intramolecular proton transfer reaction of glycine in NaCl aqueous solution2014
- Author(s)
  Y. Kasai, N. Yoshida, H. Nakano
- Journal Title
  
  J. Mol. Liq
  
  Volume: (in press) Pages: 32-37
- DOI
  10.1016/j.molliq.2014.02.013
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23550018, KAKENHI-PROJECT-25410021
[Journal Article] The "ambivalent" snug-fit sites in the KcsA potassium channel probed by 3D-RISM theory2014
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Shigetoshi Oiki, and Fumio Hirata
- Journal Title
  
  Pure Appl. Chem
  
  Volume: 86 Pages: 97-1
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] 液体の統計力学理論によるチャネルタンパクの透過現象解析2014
- Author(s)
  吉田紀生
- Journal Title
  
  膜 membrane
  
  Volume: 39 Pages: 379-384
- NAID
  130005069453
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-26104526
[Journal Article] Water-meditated forces between the nucleotide binding domains generate the power stroke in an ABC transporter2014
- Author(s)
  Furukawa-Hagiya T, Yoshida N, Chiba S, Hayashi T, Furuta T, Sohma Y, Sakurai M
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 616 - 617 Pages: 165-170
- DOI
  10.1016/j.cplett.2014.10.038
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-25293049, KAKENHI-PROJECT-25410021, KAKENHI-PUBLICLY-26104511, KAKENHI-PUBLICLY-26104526
[Journal Article] The “ambivalent” snug-fit sites in the KcsA potassium channel probed by 3D-RISM theory2014
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Shigetoshi Oiki, and Fumio Hirata
- Journal Title
  
  Pure Appl. Chem.
  
  Volume: 86 Pages: 97-104
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Theoretical Characterization of the "Ridge" in the Supercritical Region in the Fluid Phase Diagram of Water2014
- Author(s)
  Masaru Matsugami, Norio Yoshida, and Fumio Hirata
- Journal Title
  
  J. Chem. Phys
  
  Volume: 140 Issue: 10 Pages: 1045-1045
- DOI
  10.1063/1.4867974
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-25410021
[Journal Article] The "ambivalent" snug-fit sites in the KcsA potassium channel probed by "3D-RISM microscopy"2014
- Author(s)
  Phongphanphanee, S., Yoshida, N., Oiki, S. and Hirata, F
- Journal Title
  
  Pure and Applied Chemistry
  
  Volume: 86 Issue: 2 Pages: 97-104
- DOI
  10.1515/pac-2014-5018
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23370067, KAKENHI-PROJECT-24659096, KAKENHI-PROJECT-25410021
[Journal Article] Distinct Configurations of Cations and Water in the Selective Filter of the KcsA Potasium Channel Probed by the 3D-RISM Theory2014
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Shigetoshi Oiki, and Fumio Hirata
- Journal Title
  
  J. Mol. Liq
  
  Volume: 167巻 (印刷中)
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Theoretical Study of Salt Effects on Diels-Alder Reaction of Cyclopentadiene With Methyl Vinyl Ketone Using RISM-SCF Theory2013
- Author(s)
  N. Yoshida, H. Tanaka, F. Hirata
- Journal Title
  
  J. Phys. Chem. B
  
  Volume: 117(45) Issue: 45 Pages: 1411-1411
- DOI
  10.1021/jp4091552
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-22740279, KAKENHI-PROJECT-25410021
[Journal Article] Three-dimensional Reference Interaction Site Model Self-consistent Field Study of the Solvation and Electronic Structures of [Cr(H2O)6]3+ in Aqueous Solution2013
- Author(s)
  S. Fujishige, Y. Kawashima, N. Yoshida, H. Nakano
- Journal Title
  
  J. Phys. Chem. A
  
  Volume: 117 Issue: 34 Pages: 8314-8322
- DOI
  10.1021/jp405876g
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-23225001, KAKENHI-PROJECT-23550018, KAKENHI-PROJECT-25410021, KAKENHI-PROJECT-25870599
[Journal Article] Solvent effect on excited states of merocyanines : A theoretical study using the RISM-SCF method2013
- Author(s)
  Yuichi Tanaka, Norio Yoshida, Haruyuki Nakano
- Journal Title
  
  Chem. Phys. Lett
  
  Volume: 583 Pages: 69-73
- DOI
  10.1016/j.cplett.2013.08.004
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279, KAKENHI-PROJECT-23550018, KAKENHI-PROJECT-25410021
[Journal Article] Solvent dependence of Stokes shift for organic solute-solvent sysytems : A comparative study by spectroscopy and reference-interaction-site-model-self-consistent-field theory2013
- Author(s)
  Katsura Nishiyama, Yasuhiro Watanabe, Norio Yoshida, and Fumio Hirata
- Journal Title
  
  J. Chem., Phys
  
  Volume: 139 Issue: 9 Pages: 945-945
- DOI
  10.1063/1.4819268
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-22740279, KAKENHI-PROJECT-25410021, KAKENHI-PROJECT-25410211
[Journal Article] 生体分子と水:液体の積分方程式理論によるアプローチ2013
- Author(s)
  吉田紀生
- Journal Title
  
  アンサンブル
  
  Volume: 15 Pages: 42-48
- NAID
  130004566743
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279
[Journal Article] Extended Molecular Ornstein-Zernike Integral Equation for Fully Anisotropic Solute Molecules: Formulation in a Rectangular Coordinate System2013
- Author(s)
  Ryosuke Ishizuka, Norio Yoshida
- Journal Title
  
  Journal of Chemical Physics
  
  Volume: 139 Issue: 8
- DOI
  10.1063/1.4819211
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-25410021
[Journal Article] Application of efficient algorithm for solving six-dimensional molecular Ornstein-Zernike equation2012
- Author(s)
  Ryosuke Ishizuka, Norio Yoshida
- Journal Title
  
  J. Chem. Phys
  
  Volume: 136 Issue: 11
- DOI
  10.1063/1.3693623
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279, KAKENHI-PUBLICLY-23118719
[Journal Article] Solvent Effects on Electronic Structures of Coumarin 153 : Parallel Studies by Means of Spectroscopy and RISM-SCF Calculations2012
- Author(s)
  Katsura Nishiyama, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Journal of the Physical Society of Japan
  
  Volume: (掲載確定)(未定)
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article]2012
- Author(s)
  Sindhikara, Daniel; Yoshida, Norio; Hirata, Fumio
- Journal Title
  
  J. Comp. Chem
  
  Volume: 33 Pages: 1536-1543
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Placevent : An Algorithm for Predicting of Explicit Solvent Atom Distribution - Application to HIV-1 Protease and F-ATP Synthase2012
- Author(s)
  Sindhikara, Daniel; Yoshida, Norio; Hirata, Fumio
- Journal Title
  
  J. Comp. Chem
  
  Volume: 33 Issue: 18 Pages: 1536-1536
- DOI
  10.1002/jcc.22984
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002, KAKENHI-PLANNED-20107008
[Journal Article]2012
- Author(s)
  Hong, Jooyeon; Yoshida, Norio; Chong, Song-Ho; Lee, Chewook; Ham, Sihyun; Hirata, Fumio
- Journal Title
  
  J. Chem. Theory Comput
  
  Volume: 8 Pages: 2239-2246
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Solvent Effects on Electronic Structures of Coumarin 153 : Parallel Studies by Means of Spectroscopy and RISM-SCF Calculations2012
- Author(s)
  Katsura Nishiyama, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Journal of the Physical Society of Japan
  
  Volume: (掲載確定)(未定)
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-23118719
[Journal Article] Elucidating the Molecular Origin of Hydrolysis Energy of Pyrophosphate in Water2012
- Author(s)
  Hong, Jooyeon; Yoshida, Norio; Chong, Song-Ho; Lee, Chewook; Ham, Sihyun; Hirata, Fumio
- Journal Title
  
  J. Chem. Theory Comput
  
  Volume: 8 Issue: 7 Pages: 2239-2239
- DOI
  10.1021/ct300099e
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002, KAKENHI-PLANNED-20107008, KAKENHI-PUBLICLY-23118719
[Journal Article]2011
- Author(s)
  Y. Kiyota, N. Yoshida, and F. Hirata
- Journal Title
  
  J. Chem. Theor. Comp
  
  Volume: 7 Pages: 3803-3815
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Affinity of Small Ligands to Myoglobin Studied by the 3D-RISM Theory2011
- Author(s)
  Yasuomi Kiyota, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: Vol.159 Pages: 93-98
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279
[Journal Article] The electronic-structure theory of a large-molecular system in solution : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Fumio Hirata
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: Vol.159 Pages: 83-92
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] 分子認識の統計力学と生体機能2011
- Author(s)
  吉田紀生、丸山豊、Saree Phongphanphanee、清田泰臣、平田文男
- Journal Title
  
  生物物理
  
  Volume: 51 Pages: 222-225
- NAID
  10029482473
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-23118719
[Journal Article] Affinity of Small Ligands to Myoglobin Studied by the 3D-RISM Theory2011
- Author(s)
  Yasuomi Kiyota, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: Vol.159 Pages: 93-98
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] The electronic-structure theory of a large-molecular system in solution : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Fumio Hirata
- Journal Title
  
  J.Mole.Liq.
  
  Volume: 159 Issue: 1 Pages: 83-92
- DOI
  10.1016/j.molliq.2010.04.019
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008, KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-22740279
[Journal Article] The electronic-structure theory of a large-molecular system in solution : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Fumio Hirata
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: Vol.159 Pages: 83-92
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Reply to "Comment on 'Molecular Selectivity in Aquaporin Channels Studied by the 3D-RISM Theory"2011
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Journal of Physical Chemistry B
  
  Volume: 115 Issue: 25 Pages: 8367-8369
- DOI
  10.1021/jp203661z
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008, KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-22740279, KAKENHI-PUBLICLY-23118719
[Journal Article] Solvent penetration in photoactive yellow protein R52Q mutant : a theoretical study2011
- Author(s)
  Daniel, J.Sindhikara
- Journal Title
  
  J.Mol.Liq.
  
  Volume: 164 Issue: 1-2 Pages: 120-122
- DOI
  10.1016/j.molliq.2011.04.007
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107006, KAKENHI-PLANNED-20107008, KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-22740279, KAKENHI-PUBLICLY-23118719
[Journal Article] The electronic-structure theory of a large-molecular system in solution : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Fumio Hirata
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: Vol.159 Pages: 83-92
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-21107529
[Journal Article] Affinity of Small Ligands to Myoglobin Studied by the 3D-RISM Theory2011
- Author(s)
  Yasuomi Kiyota, Norio Yoshida, Fumio Hirata
- Journal Title
  
  J.Mole.Liq.
  
  Volume: 159 Issue: 1 Pages: 93-98
- DOI
  10.1016/j.molliq.2010.07.016
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008, KAKENHI-PROJECT-22245002
[Journal Article] 分子認識の統計力学と生体機能2011
- Author(s)
  吉田紀生、丸山豊、Saree Phongphanphanee、清田泰臣、平田文男
- Journal Title
  
  生物物理
  
  Volume: 51 Pages: 222-225
- NAID
  10029482473
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Statistical Mechanics Theory of Molecular Recognition and Pharmaceutical Design2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Saree Phongphanphanee, Yutaka Maruyama, Takashi Imai, Fumio Hirata
- Journal Title
  
  International Review in Physical Chemistry
  
  Volume: 30 Issue: 4 Pages: 445-478
- DOI
  10.1007/s12539-011-0104-7
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008, KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-22740279, KAKENHI-PUBLICLY-23118719
[Journal Article] The electronic-structure theory of a large-molecular system in solution : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida, Yasuomi Kiyota, Fumio Hirata
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: Vol.159 Pages: 83-92
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279
[Journal Article] 分子認識の統計力学と生体機能2011
- Author(s)
  吉田紀生、丸山豊、Saree Phongphanphanee、清田泰臣、平田文男
- Journal Title
  
  生物物理
  
  Volume: 51 Pages: 222-225
- NAID
  10029482473
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279
[Journal Article] A new approach for investigating the molecular recognition of protein : Toward structure-based drug-design based on the 3D-RISM theory2011
- Author(s)
  Yasuomi Kiyota, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Journal of Chemical Theory and Computation
  
  Volume: 7 Issue: 11 Pages: 3803-3815
- DOI
  10.1021/ct200358h
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008, KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-22740279, KAKENHI-PUBLICLY-23118719
[Journal Article] Affinity of Small Ligands to Myoglobin Studied by the 3D-RISM Theory2011
- Author(s)
  Yasuomi Kiyota, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: Vol.159 Pages: 93-98
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-21107529
[Journal Article] Molecular Recognition Explored by a Statistical-Mechanics Theory of Liquids2011
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Current Pharmaceutical Design
  
  Volume: 17 Issue: 17 Pages: 1740-1757
- DOI
  10.2174/138161211796355100
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008, KAKENHI-PROJECT-22245002, KAKENHI-PROJECT-22740279, KAKENHI-PUBLICLY-23118719
[Journal Article] 分子認識の統計力学と生体機能2011
- Author(s)
  吉田紀生、丸山豊、Saree Phongphanphanee、清田泰臣、平田文男
- Journal Title
  
  生物物理
  
  Volume: 51 Pages: 222-225
- NAID
  10029482473
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Affinity of Small Ligands to Myoglobin Studied by the 3D-RISM Theory2011
- Author(s)
  Yasuomi Kiyota, Norio Yoshida, Fumio Hirata
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: Vol.159 Pages: 93-98
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article]2011
- Author(s)
  Danniel J. Sindhikara, Norio Yoshida, Mikio Kataoka, Fumio Hirata
- Journal Title
  
  J. Mol. Liq
  
  Volume: 164 Pages: 120-122
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Journal Title
  
  Procedia Computer Science
  
  Volume: 4 Pages: 1214-1221
- DOI
  10.1016/j.procs.2011.04.130
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279, KAKENHI-PUBLICLY-23118719
[Journal Article]2010
- Author(s)
  Yutaka Maruyama, Norio Yoshida, and Fumio Hirata
- Journal Title
  
  J. Phys. Chem. B
  
  Volume: 114 Pages: 6464-6471
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Revisiting the Salt-Induced Conformational Change of DNA with 3D-RISM Theory2010
- Author(s)
  Yutaka Maruyama, Norio Yoshida, Fumio Hirata
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: Vol.114 Pages: 6464-6471
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article]2010
- Author(s)
  Saree Phongphonphanee, Thanyada Rungromongkol, Norio Yoshida, Supot Hannongbua, and Fumio Hirata
- Journal Title
  
  J. Am. Chem. Soc
  
  Volume: 132 Pages: 9782-9788
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Molecular Selectivity in Aquaporin Channels Studied by the 3D-RISM Theory2010
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Fumio Hirata
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: Vol.114 Pages: 7967-7973
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279
[Journal Article]2010
- Author(s)
  Saree Phongphonphanee, Norio Yoshida, and Fumio Hirata
- Journal Title
  
  J. Phys. Chem. B
  
  Volume: 114 Pages: 7967-7967
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Revisiting the Salt-Induced Conformational Change of DNA with 3D-RISM Theory2010
- Author(s)
  Yutaka Maruyama, Norio Yoshida, Fumio Hirata
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: Vol.114 Pages: 6464-6471
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Molecular Selectivity in Aquaporin Channels Studied by the 3D-RISM Theory2010
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Fumio Hirata
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: Vol.114 Pages: 7967-7973
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-21107529
[Journal Article] Proton Transport through the Influenza A M2 Channel: 3D-RISM Study2010
- Author(s)
  Saree Phongphonphanee, Thanyada Rungromongkol, Norio Yoshida, Supot Hannongbua, and Fumio Hirata
- Journal Title
  
  J. Am. Chem. Soc
  
  Volume: 132 Pages: 9782-9782
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Proton transport through the Influenza A M2 channel : 3D-RISM Study2010
- Author(s)
  Saree Phongphanphanee, Thanyada Rungrotmongkol, Norio Yoshida, Supot Hannongbua, Fumio Hirata
- Journal Title
  
  Journal of the American Chemical Society
  
  Volume: Vol.132 Pages: 9782-9788
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-21107529
[Journal Article] Revisiting the Salt-Induced Conformational Change of DNA with 3D-RISM Theory2010
- Author(s)
  Yutaka Maruyama, Norio Yoshida, Fumio Hirata
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: Vol.114 Pages: 6464-6471
- Peer Reviewed
- Data Source
  KAKENHI-PUBLICLY-21107529
[Journal Article] Proton transport through the Influenza A M2 channel : 3D-RISM Study2010
- Author(s)
  Saree Phongphanphanee, Thanyada Rungrotmongkol, Norio Yoshida, Supot Hannongbua, Fumio Hirata
- Journal Title
  
  Journal of the American Chemical Society
  
  Volume: Vol.132 Pages: 9782-9788
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Molecular Selectivity in Aquaporin Channels Studied by the 3D-RISM Theory2010
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Fumio Hirata
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: Vol.114 Pages: 7967-7973
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Proton Transport through the Influenza A M2 Channel : 3D-RISM Study2010
- Author(s)
  Saree Phongphonphanee, Thanyada Rungromongkol, Norio Yoshida, Supot Hannongbua, Fumio Hirata
- Journal Title
  
  J.Am.Chem.Soc. 132
  
  Pages: 9782-9788
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Molecular Selectivity in Aquaporin Channels Studied by the 3D-RISM Theory2010
- Author(s)
  Saree Phongphanphanee, Norio Yoshida, Fumio Hirata
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: Vol.114 Pages: 7967-7973
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Molecular Selectivity in Aquaporin Channels Studied by the 3D-RISM Theory2010
- Author(s)
  Saree Phongphonphanee, Norio Yoshida, and Fumio Hirata
- Journal Title
  
  J. Phys. Chem. B
  
  Volume: 114 Issue: 23 Pages: 7967-7967
- DOI
  10.1021/jp101936y
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Revisiting the Salt-induced Conformational Change of DNA with 3D-RISM Theory2010
- Author(s)
  Yutaka Maruyama, Norio Yoshida, and Fumio Hirata
- Journal Title
  
  J. Phys. Chem. B
  
  Volume: 114 Issue: 19 Pages: 6464-6464
- DOI
  10.1021/jp912141u
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22245002
[Journal Article] Revisiting the Salt-Induced Conformational Change of DNA with 3D-RISM Theory2010
- Author(s)
  Yutaka Maruyama, Norio Yoshida, Fumio Hirata
- Journal Title
  
  The Journal of Physical Chemistry B
  
  Volume: Vol.114 Pages: 6464-6471
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279
[Journal Article] Proton transport through the Influenza A M2 channel : 3D-RISM Study2010
- Author(s)
  Saree Phongphanphanee, Thanyada Rungrotmongkol, Norio Yoshida, Supot Hannongbua, Fumio Hirata
- Journal Title
  
  Journal of the American Chemical Society
  
  Volume: Vol.132 Pages: 9782-9788
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Proton transport through the Influenza A M2 channel : 3D-RISM Study2010
- Author(s)
  Saree Phongphanphanee, Thanyada Rungrotmongkol, Norio Yoshida, Supot Hannongbua, Fumio Hirata
- Journal Title
  
  Journal of the American Chemical Society
  
  Volume: Vol.132 Pages: 9782-9788
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-22740279
[Journal Article] Molecular Recognition in Biomolecules Studied by Statistical-Mechanical Integral-Equation Theory of Liquids2009
- Author(s)
  N. Yoshida, T. Imai, S. Phongphanphanee, A. Kovalenko, F. Hirata
- Journal Title
  
  Journal of Physical Chemistry B 113
  
  Pages: 873-886
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Theoretical study of CO escaping pathway in Myoglobin with 3D-RISM Theory2009
- Author(s)
  Y. Kiyota, R. Hiraoka, N. Yoshida, Y. Maruyama, T. Imai, F. Hirata
- Journal Title
  
  Journal of the American Chemical Society 131
  
  Pages: 3852-3853
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article]2009
- Author(s)
  Norio Yoshida, Takashi Imai, Saree Phongphanphanee, Andriy Kovalenko, and Fumio Hirata
- Journal Title
  
  J. Phys. Chem. B
  
  Volume: 113 Pages: 873-886
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article]2009
- Author(s)
  Yasuomi Kiyota, Ryusuke Hiraoka, Norio Yoshida, Yutaka Maruyama, Takashi Imai, and Fumio Hirata
- Journal Title
  
  J. Am. Chem. Soc
  
  Volume: 131 Pages: 3852-3853
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Molecular Recognition in Biomolecules Studied by Statistical-Mechanical Integral- Equation Theory of Liquids2009
- Author(s)
  Norio Yoshida, Takashi Imai, Saree Phongphanphanee, Andriy Kovalenko, Fumio Hirata
- Journal Title
  
  J.Phys.Chem.(Feature article) 113
  
  Pages: 873-886
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Theoretical Study of CO escaping pathway in Myoglobin with the 3D-RISM Theory2009
- Author(s)
  Yasuomi Kiyota, Ryusuke Hiraoka, Norio Yoshida, Yutaka Maruyama, Takashi Imai, Fumio Hirata
- Journal Title
  
  J.Am.Chem.Soc. 131
  
  Pages: 3852-3853
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] Theoretical Study of Temperature and Solvent Dependence of the Free Energy Surface of the Intramolecular Electron Transfer Based on the RISM-SCF Theory, Application to 1, 3-Dinitrobenzene Radical Anion in Acetonitrile and Methanol2008
- Author(s)
  N. YOSHIDA, T. ISHIDA, and F. HIRATA
- Journal Title
  
  J. Phys. Chem., (Hynes issue) 112
  
  Pages: 433-440
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-15076212
[Journal Article] On the Proton Exclusion of Aquaporins: A statistical Mechanics Study2008
- Author(s)
  S. PHONPHANPHANEE, N. YOSHIDA, and F. HIRATA
- Journal Title
  
  J. Am. Chem. Soc. (Communications) 130
  
  Pages: 1540-1541
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-15076212
[Journal Article] On the proton exclusion of aquaporins : A statistical mechanics study2008
- Author(s)
  Saree Phongphonphanee, Norio Yoshida, Fumio Hirata
- Journal Title
  
  J.Am.Chem.Soc. 130
  
  Pages: 1540-1541
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article]2008
- Author(s)
  N. Yoshida, T. Ishida, and F. Hirata
- Journal Title
  
  J. Phys. Chem
  
  Volume: 112 Pages: 433-440
- Peer Reviewed
- Data Source
  KAKENHI-PLANNED-20107008
[Journal Article] A Statistical Mechanics Study on Equilibrium Water Distribution in the Channel of Aquaporin2007
- Author(s)
  S. PHONPHANPHANEE, N. YOSHIDA, and F. HIRATA
- Journal Title
  
  Chem. Phys. Lett. 449
  
  Pages: 196-201
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-15076212
[Journal Article] Selective lon-Binding by Protein Probed with the Statistical Mechanical Integral Equation Theory2007
- Author(s)
  N. YOSHIDA, S. PHONPHANPHANEF, and F. HIRATA
- Journal Title
  
  J. Phys. Chem. B 111(17)
  
  Pages: 4588-4595
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-15076212
[Journal Article] Ab Initio Theoretical Study of Temperature and Density Dependence of Molecular and Thermodynamic Properties of Water in the Entire Fluid Region : Autoionization Processes2006
- Author(s)
  N.Yoshida, R.Ishizuka, H.Sato, F.Hirata
- Journal Title
  
  J. Phys. Chem. 110
  
  Pages: 8451-8458
- Data Source
  KAKENHI-PROJECT-15076212
[Journal Article] Selective ion-binding by protein probed with the 3D-RISM theory2006
- Author(s)
  N.Yoshida, S.Phongphanphanee, Y.Maruyama, T.Imai, F.Hirata
- Journal Title
  
  J. Am. Chem. Soc. (communication) 128
  
  Pages: 12042-12043
- Data Source
  KAKENHI-PROJECT-15076212
[Journal Article] A New Method to Determine Electrostatic Potential Around a Macromolecule in Solution from Molecular Wave Function2006
- Author(s)
  N.Yoshida, F.Hirata
- Journal Title
  
  J. Comput. Chem. 27
  
  Pages: 453-462
- Data Source
  KAKENHI-PROJECT-15076212
[Presentation] 積分方程式理論によるポリグリシン水溶液の混合熱力学と新規凝集相の解析2024
- Author(s)
  山口毅、鄭誠虎、吉田紀生
- Organizer
  研究会「凝縮系の理論化学」
- Invited
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] DEVELOPMENT OF MOLECULAR THEORY OF SOLVATION FOR BIOMOLECULAR SYSTEMS2023
- Author(s)
  Norio Yoshida
- Organizer
  ANSCSE26
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Liquid-liquid phase separation studied by reference interaction site model integral equation theory2023
- Author(s)
  T. Yamaguchi, S.-H. Chong, N. Yoshida
- Organizer
  Computational Biophysics and Chemistry Symposium
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Statistical Mechanics Analysis for Biomolecular Functions2023
- Author(s)
  Norio Yoshida
- Organizer
  15th symposium on Discovery, Fusion, Creation of New Knowledge by Multidisciplinary Computational Sciences
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Recent developments in molecular solvation theory2023
- Author(s)
  Norio Yoshida
- Organizer
  StudyCamp 2022
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Molecular Solvation Theory for Material Design2023
- Author(s)
  Norio Yoshida
- Organizer
  Asia Pacific Conference of Theoretical and Computational Chemistry
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] 生体分子の溶媒和理論に基づく溶液内分子の電子状態理論の構築と応用2023
- Author(s)
  吉田紀生
- Organizer
  第35回DV-Xα研究会
- Invited
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Development of In-Silico Material Design Tool Based on the Molecular Theory of Solvation2023
- Author(s)
  Norio Yoshida
- Organizer
  5th international conference on materials research and innovation (ICMARI2023)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] ポリマーRISM理論によるポリペプチド水溶液の相挙動の研究2023
- Author(s)
  山口毅、鄭誠虎、吉田紀生
- Organizer
  第37回分子シミュレーション討論会
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] 生体分子の構造と相互作用解析のための液体の統計力学理論開発2023
- Author(s)
  吉田紀生
- Organizer
  第23回日本蛋白質科学会年会
- Invited
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Molecular Solvation Theory for Material Design2023
- Author(s)
  Norio Yoshida
- Organizer
  Asia Pacific Conference of Theoretical and Computational Chemistry
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Statistical mechanics approach for chemical and biological processes in solution2023
- Author(s)
  Norio Yoshida
- Organizer
  令和5年度化学系学協会東北大会及び日本化学会東北支部80周年記念国際会議・物理化学コロキウム
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Recent developments in molecular solvation theory2023
- Author(s)
  Norio Yoshida
- Organizer
  StudyCamp 2022
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] 液体の統計力学理論に基づく生体分子モデリングのためのマルチスケール手法の開発2023
- Author(s)
  吉田紀生
- Organizer
  第4回生体分子シミュレーション・モデリング研究会
- Invited
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] 陰溶媒モデルを用いた高分子鎖の分子動力学シミュレーションに対する角運動量と熱浴の影響2023
- Author(s)
  山口毅、鄭誠虎、吉田紀生
- Organizer
  第25回理論化学討論会
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] 3D-RISM理論を基盤としたマルチスケール手法の開発と展開2022
- Author(s)
  吉田紀生
- Organizer
  電気化学界面シミュレーションコンソーシアム
- Invited
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Development of Dynamic Solvation Theory for Biomolecules2022
- Author(s)
  Norio Yoshida
- Organizer
  日本生物物理学会年会2022
- Invited
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Development of theory of solvation and fluctuation of biomolecule2022
- Author(s)
  Norio Yoshida
- Organizer
  Joint Meeting of the 20th KIAS Conference on "Protein Structure and Function" and The 7th Korean-Polish Conference on "Protein Folding: Theoretical and Experimental Approaches"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Theoretical study of protein structure and function based on the solvation theory of biomolecules2022
- Author(s)
  Norio Yoshida
- Organizer
  第22回日本蛋白質科学会年会
- Invited
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Theoretical study of protein structure and function based on the solvation theory of biomolecules2022
- Author(s)
  吉田紀生
- Organizer
  第22回日本蛋白質科学会年会
- Invited
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Development of a hybrid method of three-dimensional reference interaction-site model theory and quantum chemical electronic structure theory for biomoleculese2022
- Author(s)
  Norio Yoshida
- Organizer
  International Congress on Pure & Applied Chemistry Kota Kinabalu 2022
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Development of a hybrid method based on 3D-RISM theory for biomolecules2022
- Author(s)
  Norio Yoshida
- Organizer
  The 25th international annual symposium on computational science and engineering
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] 生体分子の溶媒和統計力学理論によるタンパク質機能解析への展開2022
- Author(s)
  吉田紀生
- Organizer
  物性研短期研究会2020「理論タンパク質物性科学の最前線：理論と実験の密な協働」
- Invited
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Development of a hybrid method based on 3D-RISM theory for biomolecules2022
- Author(s)
  Norio Yoshida
- Organizer
  The 25th international annual symposium on computational science and engineering
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] 生体分子の溶媒和統計力学理論によるタンパク質機能解析への展開2022
- Author(s)
  吉田紀生
- Organizer
  物性研短期研究会2020「理論タンパク質物性科学の最前線:理論と実験の密な協働」
- Invited
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Development of solvent-polarizable 3D-RISM theory2022
- Author(s)
  Norio Yoshida, Tsuyoshi Yamaguchi
- Organizer
  The World Association of Theoretical and Computational Chemists 2020
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Development of solvent-polarizable 3D-RISM theory2022
- Author(s)
  Norio Yoshida, Tsuyoshi Yamaguchi
- Organizer
  The World Association of Theoretical and Computational Chemists 2020
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Development of theory of solvation and fluctuation of biomolecule2022
- Author(s)
  Norio Yoshida
- Organizer
  Joint Meeting of the 20th KIAS Conference on "Protein Structure and Function" and The 7th Korean-Polish Conference on "Protein Folding: Theoretical and Experimental Approaches"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Development of Dynamic Solvation Theory for Biomolecules2022
- Author(s)
  Norio Yoshida
- Organizer
  日本生物物理学会年会2022
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Molecular Solvation Theory for Material Design2022
- Author(s)
  Norio Yoshida
- Organizer
  2022 International Conference on Materials Research and Innovation
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] 3D-RISM理論を基盤としたマルチスケール手法の開発と展開2022
- Author(s)
  吉田紀生
- Organizer
  電気化学界面シミュレーションコンソーシアム
- Invited
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Molecular Solvation Theory for Material Design2022
- Author(s)
  Norio Yoshida
- Organizer
  2022 International Conference on Materials Research and Innovation
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PLANNED-22H05089
[Presentation] Development of a hybrid method of three-dimensional reference interaction-site model theory and quantum chemical electronic structure theory for biomolecules2021
- Author(s)
  Norio Yoshida
- Organizer
  Pacifichem 2021
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] ensity functional theory of molecular liquids for biophysics and chemical physics2021
- Author(s)
  Norio Yoshida
- Organizer
  3rd International Conference on Materials Research and Innovation
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] MULTI-SCALE IMPLEMENTATION OF 3D-RISM TO THE ELECTRONIC STRUCTURE THEORY BEING APPLICABLE FOR SOLVATED BIOMOLECULES.2020
- Author(s)
  Norio Yoshida
- Organizer
  Biophysical Society 64th Annual Meeting
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] pKa prediction of titratable residues in protein2019
- Author(s)
  Norio Yoshida
- Organizer
  Telluride science research center workshop "The Role of Fluctuation and Dynamics in Biomolecular Function"
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Understanding Biological Processes in Solution Based on the Statistical Mechanics Theory of Liquids2019
- Author(s)
  Norio Yoshida
- Organizer
  10th International Conference of the Asian Consortium on Computational Materials Science (ACCMS-10)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] 水とイオンが駆動する生体分子機能の統計力学2019
- Author(s)
  吉田紀生
- Organizer
  有機・生体分子構造・物性研究会
- Invited
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Development of Multiscale Method for Nano-Bio Materials Design Based on Statistical Mechanics Theory of Molecular Liquids2019
- Author(s)
  Norio Yoshida
- Organizer
  International Conference on Materials Research and Innovation 2020
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] Understanding Biological Processes in Solution Based on the Statistical Mechanics Theory of Liquids2019
- Author(s)
  Norio Yoshida
- Organizer
  The 23th international annual symposium on computational science and engineering (ANSCSE23)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] 3D-RISM-SCF法によるpKa予測手法の開発2019
- Author(s)
  吉田紀生
- Organizer
  水和とATP研究会
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Understanding Biological Processes in Solution Based on the Statistical Mechanics Theory of Liquids2019
- Author(s)
  Norio Yoshida
- Organizer
  The 10th Toyota RIKEN International Workshop on Science of Life Phenomena Woven by Water and Biomolecules
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-19H02677
[Presentation] 液体の統計力学理論と量子化学による定量的pKa予測2018
- Author(s)
  吉田紀生
- Organizer
  九重分子科学セミナー2018
- Invited
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] pKaの理論的予測手法の開発2018
- Author(s)
  藤木涼，笠井友佳子，妹尾裕貴，松井亨，重田育照，吉田紀生，中野晴之
- Organizer
  凝縮系の理論化学2018
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] 液体の統計力学理論を基盤としたマルチスケール理論の開発と応用2018
- Author(s)
  吉田紀生
- Organizer
  松山道後・分子論セミナー
- Invited
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Anion effects on oligomer formation of cytochrome c with MD simulation and 3D-RISM theory2018
- Author(s)
  Hideyoshi Motoki, Norio Yoshida, Shun Hirota, Masahiro Higashi
- Organizer
  American Chemical Society meeting 2018 spring
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Multiscale modeling of solvated molecule based on the statistical mechanics integral equation theory and its applications2018
- Author(s)
  Norio Yoshida
- Organizer
  Computer aided drug design 2018
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] An MD and 3D-RISM Approach to the Ion Transport of Channel Rhodopsin2018
- Author(s)
  Norio Yoshida, Cheng Cheng, Shigehiko Hayashi
- Organizer
  American Chemical Society meeting 2018 spring
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] pKa Prediction in Biological Systems Based on the Statistical Mechanics Theory of Liquids combined with the electronic structure theory2018
- Author(s)
  Norio Yoshida
- Organizer
  PACCON2018
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] Development of Multiscale Method for Nano-Bio Materials Based on Statistical Mechanics Theory of Molecular Liquids2018
- Author(s)
  Norio Yoshida
- Organizer
  International Conference on Materials Research and Innovation
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] An MD and 3D-RISM Approach to the Ion Transport of Channel Rhodopsin2018
- Author(s)
  Norio Yoshida
- Organizer
  American Chemical Society Meeting 2018 spring
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] 液体の統計力学理論でみる生体高分子の機能と構造2018
- Author(s)
  吉田紀生
- Organizer
  平成３０年度九州地区高分子若手研究会・夏の講演会
- Invited
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] pKa Prediction in Biological Systems Based on the Statistical Mechanics Theory of Liquids combined with the electronic structure theory2018
- Author(s)
  Norio Yoshida
- Organizer
  PACCON2018
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Theoretical study of biological processes employing statistical mechanics of molecular liquids2018
- Author(s)
  Norio Yoshida
- Organizer
  The 22th international annual symposium on computational science and engineering (ANSCSE22)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] pKa Prediction in Biological Systems Based on the Statistical Mechanics Theory of Liquids combined with the electronic structure theory2017
- Author(s)
  Norio Yoshida
- Organizer
  Computer aided drug design 2017
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] Theoretical study of Zinc affinity for VHH antibody2017
- Author(s)
  Kentaro Handa, Shoichi Tanimoto, Norio Yoshida, Koki Makabe, Mitsuo Umetsu, Haruyuki Nakano
- Organizer
  "KAKENHI International Symposium on “Studying the Function of Soft Molecular Systems”"
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] Statistical mechanics theory of solvation of biomolecules2017
- Author(s)
  Norio Yoshida
- Organizer
  The 9th Conference of the Asian Consortium on Computational Materials Science
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] pKa Prediction in Biological Systems Based on the Statistical Mechanics Theory of Liquids2017
- Author(s)
  Norio Yoshida
- Organizer
  The 21th international annual symposium on computational science and engineering (ANSCSE20)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Statistical mechanics theory of solvation of biomolecules2017
- Author(s)
  Norio Yoshida
- Organizer
  The 9th Conference of the Asian Consortium on Computational Materials Science
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] 部分波展開法と3D-RISM法の結合による新たな溶媒和自由エネルギー計算式の提案2017
- Author(s)
  谷本勝一、吉田紀生、中野晴之
- Organizer
  分子科学討論会
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] 部分波展開法と3D-RISM法の結合による新たな溶媒和自由エネルギー計算式の提案2017
- Author(s)
  Shoichi Tanimoto, Norio Yoshida, Haruyuki Nakano
- Organizer
  生物物理年会
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] Theoretical study of ion transportation of light-driven channel2017
- Author(s)
  Norio Yoshida
- Organizer
  Joint EMLG/JMLG Annual Meeting 2017
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] 液体の積分方程式理論による膜イオン輸送の解析2017
- Author(s)
  吉田紀生
- Organizer
  大阪大学蛋白質研究所セミナー「膜イオン輸送の学際研究：計算科学から医学まで」
- Invited
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] Development of a theoretical prediction method for pKa2017
- Author(s)
  Ryo Fujiki, Yukako Kasai, Norio Yoshida, Toru Matsui, Yasuteru Shigeta, Haruyuki Nakano
- Organizer
  "KAKENHI International Symposium on “Studying the Function of Soft Molecular Systems”"
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] pKaの理論的予測手法の開発2017
- Author(s)
  藤木涼, 笠井友佳子, 妹尾裕貴, 松井亨, 重田育照, 吉田紀生, 中野晴之
- Organizer
  柔らかな分子系全体合宿会議
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] pKa Prediction in Biological Systems Based on the Statistical Mechanics Theory of Liquids combined with the electronic structure theory2017
- Author(s)
  Norio Yoshida
- Organizer
  Computer aided drug design 2017
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Theoretical study of ion transportation of light-driven channel2017
- Author(s)
  Norio Yoshida
- Organizer
  "KAKENHI International Symposium on “Studying the Function of Soft Molecular Systems”"
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] Theoretical study of ion transportation of light-driven channel2017
- Author(s)
  Norio Yoshida
- Organizer
  Joint EMLG/JMLG Annual Meeting 2017
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] pKa Prediction in Biological Systems Based on the Statistical Mechanics Theory of Liquids2017
- Author(s)
  Norio Yoshida
- Organizer
  The 21th international annual symposium on computational science and engineering (ANSCSE20)
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] New solvation free energy expression for the three-dimensional reference interaction site model combined with the distributed partial wave expansion correction2017
- Author(s)
  Shoichi TANIMOTO, Norio YOSHIDA, Haruyuki NAKANO
- Organizer
  "KAKENHI International Symposium on “Studying the Function of Soft Molecular Systems”"
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] FMO法と3D-RISM法の連成による生体分子の溶媒和理論2016
- Author(s)
  吉田紀生
- Organizer
  第12回FMO研究会
- Place of Presentation
  神戸大学統合研究拠点, 神戸市
- Year and Date
  2016-09-07
- Invited
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] プロトネーションと生体分子機能の予測：理論的アプローチ2016
- Author(s)
  吉田紀生
- Organizer
  2015年度第2回水和ナノ構造研究会
- Place of Presentation
  秋湯温泉，宮城県仙台市
- Year and Date
  2016-03-07
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] Theoretical study of biological processes by molecular theory of solvation2016
- Author(s)
  Norio Yoshida
- Organizer
  The 20th international annual symposium on computational science and engineering
- Place of Presentation
  Kasetsart University, Bangkok, Thai
- Year and Date
  2016-07-29
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] "Theoretical study of biological processes by molecular theory of solvation "2016
- Author(s)
  Norio Yoshida
- Organizer
  The 20th international annual symposium on computational science and engineering
- Place of Presentation
  Kasetsart University, Bangkok, Thai
- Year and Date
  2016-07-29
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] FMO法と3D-RISM法の連成による生体分子の溶媒和理論2016
- Author(s)
  吉田紀生
- Organizer
  第12回FMO研究会
- Place of Presentation
  神戸大学統合研究拠点，神戸市
- Year and Date
  2016-09-07
- Invited
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Theoretical study of biological processes employing statistical mechanics of molecular liquids2016
- Author(s)
  Norio Yoshida
- Organizer
  Pure and Applied Chemistry International Conference 2016
- Place of Presentation
  BITEC, Bangkok, Thai
- Year and Date
  2016-02-10
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] Theoretical study of ion transport in biological systems2016
- Author(s)
  Norio Yoshida
- Organizer
  Kasetsart University seminar
- Place of Presentation
  Kasetsart University, Bangkok, Thai
- Year and Date
  2016-02-09
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] "Role of calcium ion in molecular recognition process of calcium-dependent carbohydrate-binding module "2016
- Author(s)
  Shoichi Tanimoto, Masahiro Higashi, Norio Yoshida, Haruyuki Nakano
- Organizer
  Joint EMLG/JMLG Annual Meeting 2016
- Place of Presentation
  Platanias, Creta, Greece
- Year and Date
  2016-09-12
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] Selective ion adsorption of Prussian blue nanoparticle: A 3D-RISM study2016
- Author(s)
  Nirun Ruankaew, Norio Yoshida, Yoshihiro Watanabe, Haruyuki Nakano, Saree Phongphanphanee
- Organizer
  ISSPIC XVIII - International Symposium on Small Particles and Inorganic Clusters
- Place of Presentation
  Congress Centre Paviljonki, Jyvaskyla, Finland
- Year and Date
  2016-08-09
- Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] Theoretical study of biological processes based on integral equation of molecular liquids2016
- Author(s)
  Norio Yoshida
- Organizer
  International conference on computation for science and technology 2016
- Place of Presentation
  De Baron Beach resort, Langkawi, Malaysia
- Year and Date
  2016-11-04
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Theoretical study of biological processes employing statistical mechanics of molecular liquids2016
- Author(s)
  Norio Yoshida
- Organizer
  Pure and Applied Chemistry International Conference 2016
- Place of Presentation
  BITEC, Bangkok, Thai
- Year and Date
  2016-02-10
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] Theoretical study of ion transport in biological systems2016
- Author(s)
  Norio Yoshida
- Organizer
  Kasetsart University seminar
- Place of Presentation
  Kasetsart university, Bangkok, Thai
- Year and Date
  2016-02-09
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] "Role of calcium ion in molecular recognition process of calcium-dependent carbohydrate-binding module "2016
- Author(s)
  Shoichi Tanimoto, Masahiro Higashi, Norio Yoshida, Haruyuki Nakano
- Organizer
  Joint EMLG/JMLG Annual Meeting 2016
- Place of Presentation
  Platanias, Creta, Greece
- Year and Date
  2016-09-12
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] 水とイオンが駆動するタンパク質高次構造形成の統計力学2016
- Author(s)
  吉田紀生
- Organizer
  研究会「革新的酵素設計を志向したタンパク質の高次構造形成と機能デザインの最前線」
- Place of Presentation
  奈良先端科学技術大学院大学，生駒市
- Year and Date
  2016-11-30
- Invited
- Data Source
  KAKENHI-PROJECT-16K05519
[Presentation] Theoretical study of biological processes based on integral equation of molecular liquids2016
- Author(s)
  Norio Yoshida
- Organizer
  4th International Conference on Computation for Science and Technology
- Place of Presentation
  Langkawi, Malaysia
- Year and Date
  2016-11-03
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-16H00842
[Presentation] 液体の統計力学理論で見る生体分子の分子認識過程2016
- Author(s)
  吉田紀生
- Organizer
  新学術領域研究「柔らかな分子系」第14回ワークショップ『ダイナミクス観測からタンパク質の「柔らかさ」を観る』
- Place of Presentation
  不死王閣，大阪府池田市
- Year and Date
  2016-03-02
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] 液体の統計力学理論でみる膜チャネルタンパク質の物質輸送2015
- Author(s)
  吉田紀生
- Organizer
  「統合分析・生物化学研究特区」公開講演会　メンブレンサイエンス研究の新潮流
- Place of Presentation
  九州大学箱崎キャンパス
- Year and Date
  2015-03-20
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] バイオマス利用に向けた酵素反応解析2015
- Author(s)
  谷本勝一，東雅大，吉田紀生，中野晴之
- Organizer
  第６回ＣＭＳＩ研究会
- Place of Presentation
  東京大学本郷キャンパス，東京都文京区
- Year and Date
  2015-12-08
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] Multiscale implementation of 3D-RISM to the electronic structure theory being applicable for solvated biomolecules2015
- Author(s)
  Norio Yoshida
- Organizer
  Pacifichem2015
- Place of Presentation
  Honolulu convention center, Honolulu, Hawaii
- Year and Date
  2015-12-16
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] Multiscale implementation of 3D-RISM to the electronic structure theory being applicable for solvated biomolecules2015
- Author(s)
  Norio Yoshida
- Organizer
  Pacifichem2015
- Place of Presentation
  Honolulu convention center, Honolulu, Hawaii
- Year and Date
  2015-12-16
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] チャネルロドプシンのイオン透過の理論的解析2015
- Author(s)
  吉田紀生
- Organizer
  新学術領域研究「柔らかな分子系」第13回ワークショップ「光駆動ナトリウムポンプからタンパク質の柔らかさと機能のつながりを考える」
- Place of Presentation
  名鉄犬山ホテル，愛知県犬山市
- Year and Date
  2015-10-29
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] チャネルタンパク質のイオン輸送経路探索・液体論によるアプローチ2015
- Author(s)
  吉田紀生
- Organizer
  分子研研究会「膜タンパク質内部のプロトン透過を考える」
- Place of Presentation
  岡崎コンファレンスセンター，愛知県岡崎市
- Year and Date
  2015-04-20
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] 液体の統計力学理論でみる膜チャネルタンパク質の物質輸送2015
- Author(s)
  吉田紀生
- Organizer
  「統合分析・生物化学研究特区」公開講演会　メンブレンサイエンス研究の新潮流
- Place of Presentation
  九州大学箱崎キャンパス，福岡市
- Year and Date
  2015-03-20
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] Theoretical study of ion transport pathway of channelrhodopsin2015
- Author(s)
  吉田紀生
- Organizer
  "＜第11回ワークショップ＞「生体分子の機能を制御する柔らかさ」第53回生物物学会年会"
- Place of Presentation
  金沢大学角間キャンパス，石川県金沢市
- Year and Date
  2015-09-14
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] 液体の統計力学理論でみる生体分子の溶媒和2014
- Author(s)
  吉田紀生
- Organizer
  奈良先端大生体分子セミナー
- Place of Presentation
  奈良先端科学技術大学院大学，生駒市
- Year and Date
  2014-11-18
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] 液体の統計力学理論でみる生体分子の溶媒和2014
- Author(s)
  吉田紀生
- Organizer
  奈良先端大生体分子セミナー
- Place of Presentation
  奈良先端科学技術大学院大学，生駒市
- Year and Date
  2014-11-18
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] Molecular recognition in biomolecules studied by statistical-mechanics theory2014
- Author(s)
  Norio Yoshida
- Organizer
  日本化学会第94回春期年会・アジア国際シンポジウム
- Place of Presentation
  名古屋大学, 名古屋市
- Year and Date
  2014-03-29
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Molecular Recognition in Biomolecules Studied by Statistial-Mechanical Integral-Equation Theory of Liquids2014
- Author(s)
  吉田紀生
- Organizer
  兵庫県立大学大学院工学研究科物質系工学専攻･セミナー
- Place of Presentation
  兵庫県立大学姫路キャンパス，姫路市
- Year and Date
  2014-04-21
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] Molecular Recognition in Biomolecules Studied by Statistial-Mechanical Integral-Equation Theory of Liquids2014
- Author(s)
  吉田紀生
- Organizer
  兵庫県立大学大学院工学研究科物質系工学専攻･セミナー
- Place of Presentation
  兵庫県立大学・姫路キャンパス,姫路市
- Year and Date
  2014-04-21
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] 3D-RISMによるKcsAチャネル中のカチオン結合モード解析2013
- Author(s)
  吉田紀生
- Organizer
  第36回溶液化学シンポジウム
- Place of Presentation
  北海道大学学術交流会館, 札幌市
- Year and Date
  2013-10-10
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の積分方程式理論による生体分子の分子認識の理論化学2013
- Author(s)
  吉田紀生
- Organizer
  第2回分子科学若手シンポジウム
- Place of Presentation
  岡崎コンファレンスセンター, 岡崎市
- Year and Date
  2013-08-21
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 生体分子の溶媒和とリガンド認識 : 3D-RISMによるアプローチ2013
- Author(s)
  吉田紀生
- Organizer
  情報計算化学生物学会・第335回CBI研究講演会
- Place of Presentation
  東京大学山上会館, 東京都文京区
- Year and Date
  2013-03-14
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Theoretical Analysis of Co-Solvent Effects on Intramolecular Proton Transfer Reaction of Glycine in Water-Acetonitrile Mixture2013
- Author(s)
  Y. Kasai, N. Yoshida, H. Nakano
- Organizer
  33rd International Conference on Solution Chemistry
- Place of Presentation
  Kyoto
- Data Source
  KAKENHI-PROJECT-23550018
[Presentation] 液体の積分方程式理論による生体分子の分子認識の解析2013
- Author(s)
  吉田紀生
- Organizer
  日本化学会第93春期年会
- Place of Presentation
  立命館大学びわこ・草津キャンパス, 滋賀県草津市
- Year and Date
  2013-03-24
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Free Energy Analysis of ATP hydrolysis based on the statistical mechanics and quantum mechanics theory2013
- Author(s)
  吉田紀生
- Organizer
  Symposium on Hydration and ATP Energy
- Place of Presentation
  秋保温泉，仙台市
- Year and Date
  2013-03-06
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] Free Energy Analysis of ATP hydrolysis based on the statistical mechanics and quantum mechanics theory2013
- Author(s)
  Norio Yoshida
- Organizer
  Symposium on Hydration and ATP Energy
- Place of Presentation
  秋保温泉, 仙台市
- Year and Date
  2013-03-07
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 3D-RISM-SCF法によるメロシアニンの電子状態に対する溶媒効果の解析2013
- Author(s)
  田中佑一，吉田紀生，中野晴之
- Organizer
  分子科学討論会
- Place of Presentation
  京都
- Data Source
  KAKENHI-PROJECT-23550018
[Presentation] 3D-RISM-SCF Study of Solvent Effects on Excitation Spectra of Merocyanines2013
- Author(s)
  Yuichi Tanaka, Norio Yoshida, Haruyuki Nakano
- Organizer
  33rd International Conference on Solution Chemistry
- Place of Presentation
  Kyoto
- Data Source
  KAKENHI-PROJECT-23550018
[Presentation] 3D-RISM理論の基礎と生体分子の分子認識への展開2013
- Author(s)
  吉田紀生
- Organizer
  構造活性フォーラム2013
- Place of Presentation
  理化学研究所横浜研究所交流棟ホール, 神奈川県横浜市
- Year and Date
  2013-06-28
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の統計力学を用いた溶解液内化学過程の理論化学2013
- Author(s)
  吉田紀生
- Organizer
  2013年度九重分光関連夏期セミナー
- Place of Presentation
  国立大学研修センター, 大分県玖珠郡九重町
- Year and Date
  2013-07-26
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の統計力学理論による生体分子の溶媒和2013
- Author(s)
  吉田紀生
- Organizer
  慶應義塾大学理工学部物理学科談話会
- Place of Presentation
  慶應義塾大学理工学部, 横浜市
- Year and Date
  2013-11-13
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 統計力学理論による生体分子と水の理論化学2013
- Author(s)
  吉田紀生
- Organizer
  熊本大学薬学部特別講義
- Place of Presentation
  熊本大学薬学部, 熊本市
- Year and Date
  2013-11-06
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の積分方程式理論による生体分子の分子認識の解析2013
- Author(s)
  吉田紀生
- Organizer
  日本化学会第93春期年会
- Place of Presentation
  立命館大学
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 酵素反応解析へ向けた、3D-RISM理論による分子認識解析2012
- Author(s)
  吉田紀生
- Organizer
  文部科学省「革新的ハイパフォーマンス・コンピューティング・インフラ(HPCI)の構築」次世代ナノ統合シミュレーションソフトウェアの研究開発第6回公開シンポジウム
- Place of Presentation
  ニチイ学館,神戸市(兵庫県)
- Year and Date
  2012-03-06
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] RISM理論による生体分子の分子認識と化学反応へ向けた研究2012
- Author(s)
  吉田紀生
- Organizer
  スーパーコンピュータワークショップ2012
- Place of Presentation
  岡崎コンファレンスセンター,岡崎市(愛知県)
- Year and Date
  2012-01-25
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] 生体分子の水和と機能～RISM理論によるアプローチ～2012
- Author(s)
  吉田紀生
- Organizer
  新化学技術推進協会先端化学・材料技術部会コンピュータケミストリ分科会次世代CCWG講演会
- Place of Presentation
  公益社団法人新化学技術推進協会, 会議室
- Year and Date
  2012-11-09
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] バイオマス利用に向けた酵素反応解析2012
- Author(s)
  吉田紀生
- Organizer
  第2回CMSI研究会
- Place of Presentation
  東北大学金属材料研究所,仙台市(宮城県)
- Year and Date
  2012-01-31
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] RISM理論による生体分子の分子認識と化学反応へ向けた研究2012
- Author(s)
  吉田紀生
- Organizer
  スーパーコンピュータワークショップ2012
- Place of Presentation
  岡崎コンファレンスセンター,岡崎市(愛知県)
- Year and Date
  2012-01-25
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] RISM理論による生体分子の分子認識と化学反応へ向けた研究2012
- Author(s)
  吉田紀生
- Organizer
  スーパーコンピュータワークショップ2012
- Place of Presentation
  岡崎コンファレンスセンター,岡崎市(愛知県)
- Year and Date
  2012-01-25
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] 生体分子の水和と機能～ＲＩＳＭ理論によるアプローチ～2012
- Author(s)
  吉田紀生
- Organizer
  新化学技術推進協会　先端化学・材料技術部会　コンピュータケミストリ分科会次世代ＣＣＷＧ　講演会
- Place of Presentation
  公益社団法人　新化学技術推進協会　会議室，千代田区
- Year and Date
  2012-11-09
- Invited
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] 酵素反応解析へ向けた、3D-RISM理論による分子認識解析2012
- Author(s)
  吉田紀生
- Organizer
  文部科学省「革新的ハイパフォーマンス・コンピューティング・インフラ(HPCI)の構築」次世代ナノ統合シミュレーションソフトウェアの研究開発第6回公開シンポジウム
- Place of Presentation
  ニチイ学館,神戸市(兵庫県)
- Year and Date
  2012-03-06
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] 酵素反応解析へ向けた、3D-RISM理論による分子認識解析2012
- Author(s)
  吉田紀生
- Organizer
  文部科学省「革新的ハイパフォーマンス・コンピューティング・インフラ(HPCI)の構築」次世代ナノ統合シミュレーションソフトウェアの研究開発第6回公開シンポジウム
- Place of Presentation
  ニチイ学館,神戸市(兵庫県)
- Year and Date
  2012-03-06
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] 3D-RISMによるKcsAチャネル中のカチオン結合モード解析2012
- Author(s)
  Norio Yoshida
- Organizer
  アジア連携分子研研究会「実験及び理論研究手法の開拓と新規物性探索への展開/Recent development of experimental and theoretical methodology on liquids and soft matters : Basic properties and applications to novel devices」
- Place of Presentation
  分子科学研究所, 岡崎市
- Year and Date
  2012-06-02
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] RISM-SCF 法によるメロシアニン類の励起スペクトルに対する溶媒効果と溶媒和構造2012
- Author(s)
  田中佑一, 吉田紀生, 中野晴之
- Organizer
  分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-23550018
[Presentation] RISM-SCF法によるメロシアニン類の励起スペクトルに対する溶媒効果と溶媒和構造2012
- Author(s)
  田中佑一、吉田紀生、中野晴之
- Organizer
  分子科学討論会
- Place of Presentation
  東京
- Data Source
  KAKENHI-PROJECT-23550018
[Presentation] 水とタンパク質の理論化学2012
- Author(s)
  吉田紀生
- Organizer
  九州大学高等研究院/九州先端科学技術研究所・研究交流会
- Place of Presentation
  九州大学稲森会館, 福岡市
- Year and Date
  2012-12-18
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 3D-RISMによるKcsA チャネル中のカチオン結合モード解析2012
- Author(s)
  吉田紀生
- Organizer
  アジア連携分子研研究会「実験及び理論研究手法の開拓と新規物性探索への展開
- Place of Presentation
  分子科学研究所
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] バイオマス利用に向けた酵素反応解析2012
- Author(s)
  吉田紀生
- Organizer
  第2回CMSI研究会
- Place of Presentation
  東北大学金属材料研究所,仙台市(宮城県)
- Year and Date
  2012-01-31
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] バイオマス利用に向けた酵素反応解析2012
- Author(s)
  吉田紀生
- Organizer
  第2回CMSI研究会
- Place of Presentation
  東北大学金属材料研究所,仙台市(宮城県)
- Year and Date
  2012-01-31
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] RISM理論による生体分子の分子認識と化学反応へ向けた研究2012
- Author(s)
  吉田紀生
- Organizer
  スーパーコンピュータワークショップ2012
- Place of Presentation
  岡崎コンファレンスセンター,岡崎市(愛知県)
- Year and Date
  2012-01-25
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] 酵素反応解析へ向けた、3D-RISM理論による分子認識解析2012
- Author(s)
  吉田紀生
- Organizer
  文部科学省「革新的ハイパフォーマンス・コンピューティング・インフラ(HPCI)の構築」次世代ナノ統合シミュレーションソフトウェアの研究開発第6回公開シンポジウム
- Place of Presentation
  ニチイ学館,神戸市(兵庫県)
- Year and Date
  2012-03-06
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] バイオマス利用に向けた酵素反応解析2012
- Author(s)
  吉田紀生
- Organizer
  第2回CMSI研究会
- Place of Presentation
  東北大学金属材料研究所,仙台市(宮城県)
- Year and Date
  2012-01-31
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] 液体の積分方程式理論に基づく溶液内生体分子の電子状態理論2011
- Author(s)
  吉田紀生
- Organizer
  液体・溶液の微視的構造からダイナミクスまで～最近の研究結果から見えてくるもの～
- Place of Presentation
  愛媛大学,松山市(愛媛県)
- Year and Date
  2011-11-28
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] QM/MM/3D-RISM理論の開発とプログラムの高速化2011
- Author(s)
  吉田紀生
- Organizer
  第3回HPCI戦略プログラム合同研究交流会
- Place of Presentation
  計算科学研究機構,神戸市(兵庫県)
- Year and Date
  2011-10-03
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の積分方程式理論を用いた溶液内化学過程に関する研究2011
- Author(s)
  吉田紀生
- Organizer
  第34回溶液化学シンポジウム
- Place of Presentation
  名古屋大学, 名古屋市
- Year and Date
  2011-11-16
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の積分方程式理論に基づく溶液内生体分子の電子状態理論2011
- Author(s)
  吉田紀生
- Organizer
  液体・溶液の微視的構造からダイナミクスまで～最近の研究結果から見えてくるもの～
- Place of Presentation
  愛媛大学,松山市(愛媛県)
- Year and Date
  2011-11-28
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] QM/MM/3D-RISM理論の開発とプログラムの高速化2011
- Author(s)
  吉田紀生
- Organizer
  第3回HPCI戦略プログラム合同研究交流会
- Place of Presentation
  計算科学研究機構,神戸市(兵庫県)
- Year and Date
  2011-10-03
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] QM/MM/3D-RISM study of solvation and electronic structure of DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  American Physical Society Meeting 2011
- Place of Presentation
  Dallas convention center, Dallas, TX, USA
- Year and Date
  2011-03-23
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] 3D-RISMプログラムの開発と応用2011
- Author(s)
  吉田紀生、清田泰臣、Daniel J.Sindhikara、平田文男
- Organizer
  計算物質科学イニシアティブ・計算分子科学研究拠点第2回研究会
- Place of Presentation
  計算科学研究機構,神戸市(兵庫県)
- Year and Date
  2011-08-11
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Organizer
  8th Liquid Matter Conference
- Place of Presentation
  University of Vienna, Vienna, Austria
- Year and Date
  2011-09-06
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] Solvent Effects on Electronic Structures of Coumarin 153.I.RISM-SCF Analysis of the Solvent Distribution and Electronic Properties2011
- Author(s)
  Norio Yoshida, Katsura Nishiyama, Fumio Hirata
- Organizer
  EMLG/JMLG Annual Meeting 2011
- Place of Presentation
  University of Warsaw, Warsaw, Poland
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 3D-RISMプログラムの開発と応用2011
- Author(s)
  吉田紀生、清田泰臣、Daniel J.Sindhikara、平田文男
- Organizer
  計算物質科学イニシアティブ・計算分子科学研究拠点第2回研究会
- Place of Presentation
  計算科学研究機構,神戸市(兵庫県)
- Year and Date
  2011-08-11
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] 3D-RISMプログラムの開発と応用2011
- Author(s)
  吉田紀生、清田泰臣、Daniel J.Sindhikara、平田文男
- Organizer
  計算物質科学イニシアティブ・計算分子科学研究拠点第2回研究会
- Place of Presentation
  計算科学研究機構,神戸市(兵庫県)
- Year and Date
  2011-08-11
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Organizer
  International Congress on Computational Science 2011
- Place of Presentation
  Nanyang Technological University, Singapore
- Year and Date
  2011-06-02
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] QM/MM/3D-RISM理論の開発とプログラムの高速化2011
- Author(s)
  吉田紀生
- Organizer
  第3回HPCI戦略プログラム合同研究交流会
- Place of Presentation
  計算科学研究機構,神戸市(兵庫県)
- Year and Date
  2011-10-03
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Electronic structure theory of biomolecule in solution2011
- Author(s)
  Norio Yoshida, Fumio Hirata
- Organizer
  Ninth Triennial Congress of the World Association of Theoretical and Computational Chemists
- Place of Presentation
  University of Santiago, Santiago de compostela, Spain
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Organizer
  8th Liquid Matter Conference
- Place of Presentation
  University of Vienna, Vienna, Austria
- Year and Date
  2011-09-06
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の積分方程式理論を用いた溶液内化学過程に関する研究2011
- Author(s)
  吉田紀生
- Organizer
  第34回溶液化学シンポジウム
- Place of Presentation
  名古屋大学,名古屋市(愛知県)
- Year and Date
  2011-11-16
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Electronic structure theory of biomolecule in solution2011
- Author(s)
  Norio Yoshida, Fumio Hirata
- Organizer
  Ninth Triennial Congress of the World Association of Theoretical and Computational Chemists
- Place of Presentation
  University of Santiago, Santiago de compostela, Spain
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Solvent Effects on Electronic Structures of Coumarin 153. I. RISM-SCF Analysis of the Solvent Distribution and Electronic Properties2011
- Author(s)
  Norio Yoshida, Katsura Nishiyama, Fumio Hirata
- Organizer
  EMLG/JMLG Annual Meeting 2011
- Place of Presentation
  University of Warsaw, Warsaw, Poland
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Solvent Effects on Electronic Structures of Coumarin 153 : RISM-SCF Analysis2011
- Author(s)
  吉田紀生, 西山桂, 平田文男
- Organizer
  分子科学討論会2011
- Place of Presentation
  札幌コンベンションセンター、札幌市(北海道)
- Year and Date
  2011-09-20
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Yoshida Norio
- Organizer
  Third Korea-Japan Seminars on Biomolecular Sciences-Experiments and Simulations
- Place of Presentation
  Lotte hotel, Jeju, Korea
- Year and Date
  2011-02-28
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] バイオマス利用に向けた酵素反応解析2011
- Author(s)
  吉田紀生
- Organizer
  物性研・CMSI・次世代ナノ情報合同研究会「計算物質科学の課題と展望」
- Place of Presentation
  東京大学物性研究所、千葉県
- Year and Date
  2011-01-07
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  Statistical Mechanics Approaches to Nano/Bio-Sciences
- Place of Presentation
  Sookmyung Women's University, Soeul, Korea
- Year and Date
  2011-06-13
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] 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
- Author(s)
  吉田紀生
- Organizer
  「水を主役としたATPエネルギー変換」後期第一回研究会議
- Place of Presentation
  大阪ガーデンパレス,大阪市(大阪府)
- Year and Date
  2011-08-11
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Organizer
  8th Liquid Matter Conference
- Place of Presentation
  University of Vienna, Vienna, Austria
- Year and Date
  2011-09-06
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Electronic structure theory of biomolecule in solution2011
- Author(s)
  Norio Yoshida, Fumio Hirata
- Organizer
  Ninth Triennial Congress of the World Association of Theoretical and Computational Chemists
- Place of Presentation
  University of Santiago, Santiago de compostela, Spain
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] Solvent Effects on Electronic Structures of Coumarin 153 : RISM-SCF Analysis2011
- Author(s)
  吉田紀生, 西山桂, 平田文男
- Organizer
  分子科学討論会2011
- Place of Presentation
  札幌コンベンションセンター、札幌市(北海道)
- Year and Date
  2011-09-20
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Yoshida Norio
- Organizer
  Third Korea-Japan Seminars on Biomolecular Sciences-Experiments and Simulations
- Place of Presentation
  Lotte hotel, Jeju, Korea
- Year and Date
  2011-02-28
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Organizer
  International Congress on Computational Science 2011
- Place of Presentation
  Nanyang Technological University, Singapore
- Year and Date
  2011-06-02
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  Third Korea-Japan Seminars on Biomolecular Sciences - Experiments and Simulations
- Place of Presentation
  Lotte hotel, Jeju, Korea
- Year and Date
  2011-02-28
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  Third Korea-Japan Seminars on Biomolecular Sciences-Experiments and Simulations
- Place of Presentation
  Lotte hotel, Jeju, Korea
- Year and Date
  2011-02-28
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  Statistical Mechanics Approaches to Nano/Bio-Sciences
- Place of Presentation
  Sookmyung Women's University, Seoul, Korea
- Year and Date
  2011-06-13
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 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
- Author(s)
  吉田紀生
- Organizer
  「水を主役としたATPエネルギー変換」後期第一回研究会議
- Place of Presentation
  大阪ガーデンパレス,大阪市(大阪府)
- Year and Date
  2011-08-11
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] Solvent Effects on Electronic Structures of Coumarin 153.I.RISM-SCF Analysis of the Solvent Distribution and Electronic Properties2011
- Author(s)
  Norio Yoshida, Katsura Nishiyama, Fumio Hirata
- Organizer
  EMLG/JMLG Annual Meeting 2011
- Place of Presentation
  University of Warsaw, Warsaw, Poland
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] バイオマス利用に向けた酵素反応解析2011
- Author(s)
  吉田紀生
- Organizer
  物性研・CMSI・次世代ナノ情報合同研究会「計算物質科学の課題と展望」
- Place of Presentation
  東京大学物性研究所、千葉県
- Year and Date
  2011-01-07
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] 液体の積分方程式理論を用いた溶液内化学過程に関する研究2011
- Author(s)
  吉田紀生
- Organizer
  第34回溶液化学シンポジウム
- Place of Presentation
  名古屋大学,名古屋市(愛知県)
- Year and Date
  2011-11-16
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Organizer
  International Congress on Computational Science 2011
- Place of Presentation
  Nanyang Technological University, Singapore
- Year and Date
  2011-06-02
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  Statistical Mechanics Approaches to Nano/Bio-Sciences
- Place of Presentation
  Sookmyung Women's University, Soeul, Korea
- Year and Date
  2011-06-13
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 3D-RISMプログラムの開発と応用2011
- Author(s)
  吉田紀生、清田泰臣、Daniel J.Sindhikara、平田文男
- Organizer
  計算物質科学イニシアティブ・計算分子科学研究拠点第2回研究会
- Place of Presentation
  計算科学研究機構,神戸市(兵庫県)
- Year and Date
  2011-08-11
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Solvent Effects on Electronic Structures of Coumarin 153 : RISM-SCF Analysis2011
- Author(s)
  吉田紀生, 西山桂, 平田文男
- Organizer
  分子科学討論会2011
- Place of Presentation
  札幌コンベンションセンター,札幌市(北海道)
- Year and Date
  2011-09-20
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] QM/MM/3D-RISM study of solvation and electronic structure of DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  American Physical Society Meeting 2011
- Place of Presentation
  Dallas convention center, Dallas, TX, USA
- Year and Date
  2011-03-23
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Organizer
  8th Liquid Matter Conference
- Place of Presentation
  University of Vienna, Vienna, Austria
- Year and Date
  2011-09-06
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] 液体の積分方程式理論を用いた溶液内化学過程に関する研究2011
- Author(s)
  吉田紀生
- Organizer
  第34回溶液化学シンポジウム
- Place of Presentation
  名古屋大学,名古屋市(愛知県)
- Year and Date
  2011-11-16
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] 液体の積分方程式理論に基づく溶液内生体分子の電子状態理論2011
- Author(s)
  吉田紀生
- Organizer
  研究会「液体・溶液の微視的構造からダイナミクスまで～最近の研究結果から見えてくるもの～」
- Place of Presentation
  愛媛大学, 松山市
- Year and Date
  2011-11-29
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の積分方程式理論を用いた溶液内化学過程に関する研究2011
- Author(s)
  吉田紀生
- Organizer
  第34回溶液化学シンポジウム
- Place of Presentation
  名古屋大学,名古屋市(愛知県)
- Year and Date
  2011-11-16
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  Statistical Mechanics Approaches to Nano/Bio-Sciences
- Place of Presentation
  Sookmyung Women's University, Soeul, Korea
- Year and Date
  2011-06-13
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] Solvent Effects on Electronic Structures of Coumarin 153.I.RISM-SCF Analysis of the Solvent Distribution and Electronic Properties2011
- Author(s)
  Norio Yoshida, Katsura Nishiyama, Fumio Hirata
- Organizer
  EMLG/JMLG Annual Meeting 2011
- Place of Presentation
  University of Warsaw, Warsaw, Poland
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] 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
- Author(s)
  吉田紀生
- Organizer
  「水を主役としたATPエネルギー変換」後期第一回研究会議
- Place of Presentation
  大阪ガーデンパレス,大阪市(大阪府)
- Year and Date
  2011-08-11
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] QM/MM/3D-RISM理論の開発とプログラムの高速化2011
- Author(s)
  吉田紀生
- Organizer
  第3回HPCI戦略プログラム合同研究交流会
- Place of Presentation
  計算科学研究機構,神戸市(兵庫県)
- Year and Date
  2011-10-03
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] 液体の積分方程式理論に基づく溶液内生体分子の電子状態理論2011
- Author(s)
  吉田紀生
- Organizer
  液体・溶液の微視的構造からダイナミクスまで～最近の研究結果から見えてくるもの～
- Place of Presentation
  愛媛大学,松山市(愛媛県)
- Year and Date
  2011-11-28
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] Electronic structure theory of biomolecule in solution2011
- Author(s)
  Norio Yoshida, Fumio Hirata
- Organizer
  Ninth Triennial Congress of the World Association of Theoretical and Computational Chemists
- Place of Presentation
  University of Santiago, Santiago de compostela, Spain
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] QM/MM/3D-RISM study of solvation and electronic structure of DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  American Physical Society Meeting 2011
- Place of Presentation
  Dallas convention center, Dallas, TX, USA
- Year and Date
  2011-03-23
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 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
- Author(s)
  吉田紀生
- Organizer
  「水を主役としたATPエネルギー変換」後期第一回研究会議
- Place of Presentation
  大阪ガーデンパレス,大阪市(大阪府)
- Year and Date
  2011-08-11
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] Solvent Effects on Electronic Structures of Coumarin 153 : RISM-SCF Analysis2011
- Author(s)
  吉田紀生, 西山桂, 平田文男
- Organizer
  分子科学討論会2011
- Place of Presentation
  札幌コンベンションセンター、札幌市(北海道)
- Year and Date
  2011-09-20
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2011
- Author(s)
  Norio Yoshida
- Organizer
  Statistical Mechanics Approaches to Nano/Bio-Sciences
- Place of Presentation
  Sookmyung Women's University, Soeul, Korea
- Year and Date
  2011-06-13
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Molecular Ornstein-Zernike self-consistent-field approach to hydrated electron2011
- Author(s)
  Norio Yoshida
- Organizer
  International Congress on Computational Science 2011
- Place of Presentation
  Nanyang Technological University, Singapore
- Year and Date
  2011-06-02
- Data Source
  KAKENHI-PLANNED-20107008
[Presentation] バイオマス利用に向けた酵素反応解析2011
- Author(s)
  吉田紀生
- Organizer
  物性研・CMSI・次世代ナノ情報合同研究会「計算物質科学の課題と展望」
- Place of Presentation
  東京大学物性研究所、千葉県
- Year and Date
  2011-01-07
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 液体の積分方程式理論に基づく溶液内生体分子の電子状態理論2011
- Author(s)
  吉田紀生
- Organizer
  液体・溶液の微視的構造からダイナミクスまで～最近の研究結果から見えてくるもの～
- Place of Presentation
  愛媛大学,松山市(愛媛県)
- Year and Date
  2011-11-28
- Data Source
  KAKENHI-PUBLICLY-23118719
[Presentation] QM/MM/RISM理論によるDNAインターカレーションの解析2010
- Author(s)
  吉田紀生
- Organizer
  第13回理論化学討論会
- Place of Presentation
  北海道大学学術交流会館、北海道
- Year and Date
  2010-05-24
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/RISM理論によるDNAインターカレーションの解析2010
- Author(s)
  吉田紀生
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪大学、大阪府
- Year and Date
  2010-09-15
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] QM/MM/3D-RISMの開発と応用2010
- Author(s)
  吉田紀生、平田文男
- Organizer
  スーパーコンピューターワークショップ2010
- Place of Presentation
  岡崎コンファレンスセンター(愛知県)
- Year and Date
  2010-01-13
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/3D-RISM study of solvation and electronic structure of DNA2010
- Author(s)
  Norio Yoshida
- Organizer
  EMLG-JMLG Annual Meeting 2010
- Place of Presentation
  Ivan Franko National University, Lviv, Ukraine
- Year and Date
  2010-09-07
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2010
- Author(s)
  Norio Yoshida
- Organizer
  Pacifichem 2011
- Place of Presentation
  Hawaii convention center, Honolulu, Hawaii, USA
- Year and Date
  2010-12-18
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] QM/MM/RISM理論によるDNAインターカレーションの解析2010
- Author(s)
  吉田紀生
- Organizer
  第13回理論化学討論会
- Place of Presentation
  北海道大学学術交流会館、北海道
- Year and Date
  2010-05-24
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] QM/MM/3D-RISM study of solvation and electronic structure of DNA2010
- Author(s)
  吉田紀生、平田文男
- Organizer
  239th American Chemical Society National Meeting & Exposition
- Place of Presentation
  San Fransisco(USA)
- Year and Date
  2010-03-23
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/RISM理論によるDNAインターカレーションの解析2010
- Author(s)
  吉田紀生
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪大学、大阪府
- Year and Date
  2010-09-15
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] QM/MM/RISM理論の開発とその応用2010
- Author(s)
  吉田紀生
- Organizer
  第24回分子シミュレーション討論会
- Place of Presentation
  AOSSA福井、福井県
- Year and Date
  2010-11-25
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] QM/MM/3D-RISM study of solvation and electronic structure of DNA2010
- Author(s)
  吉田紀生、平田文男
- Organizer
  文部科学省「最先端・高性能汎用スーパーコンピューターの開発利用」プロジェクト次世代ナノ統合シミュレーションソフトウェアの研究開発第4回公開シンポジウム
- Place of Presentation
  岡崎コンファレンスセンター(愛知県)
- Year and Date
  2010-03-03
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/RISM理論の開発とその応用2010
- Author(s)
  吉田紀生
- Organizer
  第24回分子シミュレーション討論会
- Place of Presentation
  AOSSA福井、福井県
- Year and Date
  2010-11-25
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] QM/MM/RISM理論の開発と応用2010
- Author(s)
  吉田紀生
- Organizer
  第33回溶液化学シンポジウム
- Place of Presentation
  京都大学100周年記念会館、京都府
- Year and Date
  2010-11-17
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] QM/MM/RISM理論によるDNAインターカレーションの解析2010
- Author(s)
  吉田紀生
- Organizer
  第13回理論化学討論会
- Place of Presentation
  北海道大学学術交流会館、北海道
- Year and Date
  2010-05-24
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2010
- Author(s)
  Norio Yoshida
- Organizer
  Pacifichem 2011
- Place of Presentation
  Hawaii convention center, Honolulu, Hawaii, USA
- Year and Date
  2010-12-18
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] QM/MM/RISM理論の開発と応用2010
- Author(s)
  吉田紀生
- Organizer
  第33回溶液化学シンポジウム
- Place of Presentation
  京都大学100周年記念会館、京都府
- Year and Date
  2010-11-17
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] "計算科学"と"計算機科学"の連携による統計力学理論の超高並列化への挑戦2010
- Author(s)
  吉田紀生
- Organizer
  SS研HPCフォーラムe-scienceのフロンティア
- Place of Presentation
  汐留シティセンター、東京都
- Year and Date
  2010-08-26
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] QM/MM/3D-RISM study of solvation and electronic structure of DNA2010
- Author(s)
  Norio Yoshida
- Organizer
  EMLG-JMLG Annual Meeting 2010
- Place of Presentation
  Ivan Franko National University, Lviv, Ukraine
- Year and Date
  2010-09-07
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] Development of the QM/MM/RISM theory : Application to the intercalation of proflavine with solvated DNA2010
- Author(s)
  Norio Yoshida
- Organizer
  Pacifichem 2011
- Place of Presentation
  Hawaii convention center, Honolulu, Hawaii, USA
- Year and Date
  2010-12-18
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/3D-RISM study of solvation and electronic structure of DNA2010
- Author(s)
  Norio Yoshida
- Organizer
  EMLG-JMLG Annual Meeting 2010
- Place of Presentation
  Ivan Franko National University, Lviv, Ukraine
- Year and Date
  2010-09-07
- Data Source
  KAKENHI-PROJECT-22245002
[Presentation] "計算科学"と"計算機科学"の連携による統計力学理論の超高並列化への挑戦2010
- Author(s)
  吉田紀生
- Organizer
  SS研HPCフォーラムe-scienceのフロンティア
- Place of Presentation
  汐留シティセンター、東京都
- Year and Date
  2010-08-26
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] "計算科学"と"計算機科学"の連携による統計力学理論の超高並列化への挑戦2010
- Author(s)
  吉田紀生
- Organizer
  SS研HPCフォーラムe-scienceのフロンティア
- Place of Presentation
  汐留シティセンター、東京都
- Year and Date
  2010-08-26
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/RISM理論によるDNAインターカレーションの解析2010
- Author(s)
  吉田紀生
- Organizer
  第4回分子科学討論会
- Place of Presentation
  大阪大学、大阪府
- Year and Date
  2010-09-15
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/RISM理論の開発とその応用2010
- Author(s)
  吉田紀生
- Organizer
  第24回分子シミュレーション討論会
- Place of Presentation
  AOSSA福井、福井県
- Year and Date
  2010-11-25
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/RISM理論の開発と応用2010
- Author(s)
  吉田紀生
- Organizer
  第33回溶液化学シンポジウム
- Place of Presentation
  京都大学100周年記念会館、京都府
- Year and Date
  2010-11-17
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 3D-RISM理論による蛋白質の分子認識の解析2009
- Author(s)
  吉田紀生、平田文男
- Organizer
  第12回理論化学討論会
- Place of Presentation
  武田先端知ビル(東京都)
- Year and Date
  2009-05-29
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] Density-functional theoretical study combined with integral equation theory on wet-DNA2009
- Author(s)
  吉田紀生、平田文男
- Organizer
  EMLG/JMLG Annual Meeting "Intermolecular Interactions and Liquid Structure"
- Place of Presentation
  Salzburg(Austria)
- Year and Date
  2009-09-08
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] 液体の積分方程式理論の解法と、電子状態計算との連成時の問題2009
- Author(s)
  吉田紀生
- Organizer
  アルゴリズムによる計算科学の融合と発展
- Place of Presentation
  筑波大学計算科学研究センター(茨城県)
- Year and Date
  2009-04-22
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] QM/MM/3D-RISMによるDNAの水和構造と電子状態の研究2009
- Author(s)
  吉田紀生、平田文男
- Organizer
  第32回溶液化学シンポジウム
- Place of Presentation
  朱鷺メッセ(新潟県)
- Year and Date
  2009-11-19
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] Density-functional theoretical study combined with integral equation theory on wet-DNA2009
- Author(s)
  吉田紀生、平田文男
- Organizer
  13th International Conference on the Application of Density Functional Theory in Chemistry and Physics, DFT2009
- Place of Presentation
  Lyon(France)
- Year and Date
  2009-09-02
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] 3D-RISM理論によるタンパク質の分子認識の解析2009
- Author(s)
  吉田紀生
- Organizer
  大阪大学蛋白質研究所セミナー分子科学を基盤とした生命活動への理論的アプローチ
- Place of Presentation
  大阪大学蛋白質研究所(大阪府)
- Year and Date
  2009-12-03
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] Theoretical Study of electronic structure of wet-DNA2009
- Author(s)
  吉田紀生、平田文男
- Organizer
  揺らぎが機能を決める生命分子の科学第3回公開シンポジウム
- Place of Presentation
  名古屋大学豊田講堂(愛知県)
- Year and Date
  2009-12-20
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] 3D-RISM理論の生体分子への応用と次世代スーパーコンピューターでの展開2009
- Author(s)
  吉田紀生
- Organizer
  第22期CAMMフォーラム
- Place of Presentation
  虎ノ門パストラル(東京都)
- Year and Date
  2009-08-07
- Data Source
  KAKENHI-PUBLICLY-21107529
[Presentation] Molecular recognition in biomolecules studied by statistical-mechanics theory
- Author(s)
  吉田紀生
- Organizer
  日本化学会第94回春期年会・アジア国際シンポジウム
- Place of Presentation
  名古屋市・名古屋大学
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] チャネルロドプシンのイオン輸送経路の理論化学
- Author(s)
  吉田紀生
- Organizer
  柔らかな分子系第2回公開シンポジウム
- Place of Presentation
  大阪大学会館，豊中市
- Year and Date
  2014-11-28 – 2014-11-29
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] 液体の統計力学を用いた溶解液内化学過程の理論化学
- Author(s)
  吉田紀生
- Organizer
  2013年度九重分光関連セミナー
- Place of Presentation
  大分県玖珠郡九重町，国立大学研修センター
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] 生体高分子と水の理論化学
- Author(s)
  吉田紀生
- Organizer
  コロイド＆界面科学研究会　第2回セミナー
- Place of Presentation
  信州大学工学部　信州科学技術総合振興センター
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] Efficient Implementation of 3D-RISM Theory to the FMO Method, and Its Applications
- Author(s)
  Norio Yoshida
- Organizer
  International Meeting on Applications of Statistical Mechanics of Molecular Liquid on Soft Matter
- Place of Presentation
  Kasesart University, Bangkok
- Year and Date
  2014-09-14 – 2014-09-17
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526
[Presentation] Efficient Implementation of 3D-RISM Theory to the FMO Method, and Its Applications
- Author(s)
  Norio Yoshida
- Organizer
  International Meeting on Applications of Statistical Mechanics of Molecular Liquid on Soft Matter
- Place of Presentation
  Kasesart University, Bangkok, Thai
- Year and Date
  2014-09-14 – 2014-09-17
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] 生体分子の溶媒和とリガンド認識：3D-RISMによるアプローチ
- Author(s)
  吉田紀生
- Organizer
  情報計算化学生物学会・第335回CBI研究講演会
- Place of Presentation
  東京大学山上会館
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] 3D-RISM理論の基礎と生体分子の分子認識への展開
- Author(s)
  吉田紀生
- Organizer
  構造活性フォーラム２０１３
- Place of Presentation
  横浜市・理化学研究所横浜研究所交流棟ホール
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] 3D-RISMによるKcsAチャネル中のカチオン結合モード解析
- Author(s)
  吉田紀生
- Organizer
  第36回溶液化学シンポジウム
- Place of Presentation
  札幌市・北海道大学学術交流会館
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] 液体の積分方程式理論による生体分子の分子認識の理論化学
- Author(s)
  吉田紀生
- Organizer
  第2回分子科学若手シンポジウム
- Place of Presentation
  岡崎市・岡崎コンファレンスセンター
- Invited
- Data Source
  KAKENHI-PROJECT-25410021
[Presentation] 生体分子の水和と機能～ＲＩＳＭ理論によるアプローチ～
- Author(s)
  吉田紀生
- Organizer
  新化学技術推進協会　先端化学・材料技術部会　コンピュータケミストリ分科会次世代ＣＣＷＧ　講演会
- Place of Presentation
  公益社団法人　新化学技術推進協会
- Invited
- Data Source
  KAKENHI-PROJECT-22740279
[Presentation] チャネルロドプシンのイオン輸送経路の理論化学
- Author(s)
  吉田紀生
- Organizer
  柔らかな分子系第2回公開シンポジウム
- Place of Presentation
  大阪大学会館，豊中市
- Year and Date
  2014-11-28 – 2014-11-29
- Invited
- Data Source
  KAKENHI-PUBLICLY-26104526

1. 山口毅 (80345917)

# of Collaborated Projects: 4 results

# of Collaborated Products: 16 results
2. HIRATA Fumio (90218785)

# of Collaborated Projects: 3 results

# of Collaborated Products: 78 results
3. NAKANO Haruyuki (90251363)

# of Collaborated Projects: 3 results

# of Collaborated Products: 23 results
4. WATANABE Yoshihiro (20315055)

# of Collaborated Projects: 2 results

# of Collaborated Products: 1 results
5. 菅瀬謙治 (00300822)

# of Collaborated Projects: 2 results

# of Collaborated Products: 0 results
6. KAWASHIMA Yukio (90452739)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
7. TSUNEDA Takao (20312994)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
8. NISHIYAMA KATSURA (40283725)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
9. 今井隆志 (30373096)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
10. 鄭誠虎 (40390645)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
11. 関山直孝 (50758810)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
12. 中村秀樹 (50435666)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
13. 池田将 (20432867)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
14. 張賀東 (80345925)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
15. 塚本眞幸 (10362295)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
16. 東直輝 (50823283)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
17. 宋玉璽 (51002646)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
18. 安田耕二 (70293686)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
19. 眞壁幸樹 (20508072)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
20. 矢野成和 (50411228)

# of Collaborated Projects: 1 results

# of Collaborated Products: 0 results
21. HONGOU Kenta

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results
22. HAYASHI Shigehiko

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results
23. 東雅大

# of Collaborated Projects: 0 results

# of Collaborated Products: 3 results
24. 桜井実

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results
25. 相馬義郎

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results
26. 水上渉

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results
27. 老木成稔

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results

Yoshida Norio 吉田 紀生

YOSHIDA Norio 吉田 紀生

吉田 紀生 ヨシダ ノリオ

Research Projects

Research Products

Co-Researchers

Investigation of molecular aggregation control mechanism by solution environment and creation of molecular design toolsPrincipal Investigator

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Optimal Molecular Design of Polymeric Organic Friction Modifiers: A Computational Scheme Linking Molecular Structure to Macroscopic Frictional Properties

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動的溶液科学の推進

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Theoretical study of self-condensation process of intrinsically disordered proteins in dynamic solution environmentPrincipal Investigator

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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

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Development of electron transfer dynamics theory of biological systems highly incorporating solvent responsePrincipal Investigator

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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Principal Investigator

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Statistical mechanics study on higher-order structure formation of proteins driven by water and ionsPrincipal Investigator

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チャネルロドプシンのイオン輸送の理論化学Principal Investigator

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Theoretical study on the charge transfer through DNA induced by structural and solvent fluctuationPrincipal Investigator

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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Principal Investigator

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Development of multiconfigurational electronic structure theory and simulation method for quasidegenerate systems in solution

Principal Investigator

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Statistical Mechanics Theory of Ion Channel

Principal Investigator

Yoshida Norio 吉田紀生

YOSHIDA Norio 吉田紀生

吉田紀生ヨシダノリオ

[Book] "水と生体分子のハーモニー", 巨大分子系の計算化学超大型計算機時代の理論化学の新展開15章2012