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nagao hidemi  長尾 秀実

ORCIDConnect your ORCID iD *help
… Alternative Names

長尾 秀実  ナガオ ヒデミ

NAGAO Hidemi  長尾 秀実

長尾 秀美  ナガオ ヒデミ

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Researcher Number 30291892
Other IDs
External Links
Affiliation (Current) 2025: 金沢大学, 数物科学系, 教授
Affiliation (based on the past Project Information) *help 2023: 金沢大学, 数物科学系, 教授
2011 – 2017: 金沢大学, 数物科学系, 教授
2014: 金沢大学, 自然科学研究科(大学院), 教授
2013: 金沢大学, 大学院・自然科学研究科, 助教
2012: 金沢大学, 数物科学系, 数物科学系 … More
2011: 金沢大学, 自然科学研究科, 教授
2010: 金沢大学, 大学院・自然科学研究科, 助教
2007 – 2010: 金沢大学, 大学院・自然科学研究科, 教授
2008 – 2009: Kanazawa University, 数物科学系, 教授
2006 – 2008: 金沢大学, 自然科学研究科, 教授
2005: 金沢大学, 自然学研究科, 助教授
2004 – 2005: KANAZAWA UNIVERSITY, GRADUATE SCHOOL OF NATURAL SCIENCE AND TECHNOLOGY, ASSOCIATE PROFESSOR, 自然科学研究科, 助教授
2000 – 2003: 金沢大学, 理学部, 助教授
1998 – 1999: 大阪大学, 大学院・理学研究科, 助手 Less
Review Section/Research Field
Principal Investigator
Science and Engineering / Basic Section 13040:Biophysics, chemical physics and soft matter physics-related / Physical chemistry / Biological physics/Chemical physics/Soft matter physics / Polymer chemistry / Physical chemistry
Except Principal Investigator
Functional materials chemistry / Physical chemistry / Environmental chemistry / General mathematics (including Probability theory/Statistical mathematics) / Biophysics / Physical chemistry / Science and Engineering
Keywords
Principal Investigator
超伝導 / シミュレーション / 有機分子性結晶 / 分子動力学シミュレーション / 電子状態 / 分子動力学法 / 活性部位 / 振動モード / 会合解離 / タンパク質複合体 … More / タンパク質 / 磁性 / エキシトン / 電子移動 / 生物物理 / グラナチラコイド / パターン形成 / 粗視化モデル / 形態形成 / チラコイド膜 / 膜タンパク質 / electron pair scattering process / electron-phonon interaction / effective electron interactions / many band system / crystal structure / magnetism / many-gap superconductivity / superconductivity / 無機結晶 / 2重バンド / 電子対散乱過程 / 電子-格子相互作用 / 有効電子間相互作用 / 多重バンド / 結晶構造 / 多重超伝導ギャップ / シトクロムb6/f / 酸化還元電位 / 光照射ストレス / 拡散過程 / シトクロムf / プラストシアニン / 会合解離過程 / 電子伝達体 / 光化学反応 / ミセル / 脂質 / 脂質ミセル / 高分子 / 自己組織化 / 引き込み現象 / 溶媒和自由エネルギー / 構造安定性 / 結合エネルギー / 複合体 / 自由エネルギー / スピン / レーザー制御 / 分子性固体 / 超伝導材料素子 / 高性能レーザー / 化学物理 / 制御 / 物性 / レーザー / 結晶 / 外場誘導超伝導 / 外場 / 多重バンド効果 / グリーン関数法 / 非断熱過程 / 強レーザー場 / 量子ダイナミックス / 密度汎関数法 / 2バンドモデル / 三重項超伝導 / ホールドープ / 強磁性金属相 / 有機強磁性 / エキシトン機構超伝導 / 有機超伝導 / 電子移動系 / スピントンネル / π共役ラジカル … More
Except Principal Investigator
炭酸脱水酵素 / 伝導性 / 電子波束 / 磁性 / 磁気異方性 / correlation potential / nonadiabatic transition / selective bond dissociation / hydrogen molecular ion / time-dependent adiabatic state / nuclear wave packet / electronic wave packet / time-dependent density functional theory / 時断依存断熱状態 / 相関ポテンシャル / 非断熱遷移 / 選択的結合解離 / 水素分子イオン / 時間依存断熱状態 / 核波束 / 時間依存密度汎関数法 / CCS / CCS / ナクレイン / 固体炭酸 / 二酸化炭素 / 地球温暖化 / バイオミメティクス / 化学反応性 / 磁気特性 / 光特性 / サブナノクラスター / 理論計算 / ナノ材料 / 量子化学計算 / 光物性 / 金属錯体 / コロイド・超微粒子 / 擬縮重多電子系 / 応用数学 / 非線形拡散モデル / 反応拡散モデル / イーデンパターン / 同心円パターン / 数理モデル / モロフォロジーダイアグラム / 粒子運動モデル / 反応拡散系 / 構造機能相関 / 触媒機構 / MM / QM / NMR / プロトン移動 / 反応機構 / 触媒 / 互変異性 / ヒスチジン / 機能 / 酵素 / タンパク質 / 磁気的相互作 / 第一原理計算 / スピンシミュレーション / 有効交換相互作用 / 有機金属錯体 / 磁気的相互作用 / 有機磁性体 / 動力学理論 / 多重イオン化 / 光電子スペクトル / 高次高調波 / 電子動力学理論 / レーザー / イオン化 / 原子・分子物理 / 強レーザー場イオン化 / 多配置時間依存ハートリー-フォック法 / 窒化物 / 酸素 / リチウム / ヨウ素 / リン / 圧力誘起相転移 / メタ・ダイナミクス / 新物質 / 構造相転移 / 圧力誘起超伝導 / 固体酸素 / 圧力テンソル / p 電子強磁性体 / ハーフメタル / 構造探索 / メタダイナミクス / カーボンナノチューブ / 変調構造 / 分子性固体 / 高圧 / 超伝導 Less
  • Research Projects

    (21 results)
  • Research Products

    (180 results)
  • Co-Researchers

    (29 People)
  •  Theoretical studies on membrane deformation patterns of grana thylakoid morphogenic membrane proteinsPrincipal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      2023 – 2026
    • Research Category
      Grant-in-Aid for Scientific Research (C)
    • Review Section
      Basic Section 13040:Biophysics, chemical physics and soft matter physics-related
    • Research Institution
      Kanazawa University
  •  Theoretical study on dynamics of electron carriers in photosynthesis stressed by light irradiationPrincipal Investigator

    • Principal Investigator
      Nagao Hidemi
    • Project Period (FY)
      2014 – 2017
    • Research Category
      Grant-in-Aid for Scientific Research (C)
    • Research Field
      Biological physics/Chemical physics/Soft matter physics
    • Research Institution
      Kanazawa University
  •  Development of Biomimetic System using Carbonic Anhydrase Incorporated into CO2 Capture and Storage - Transformation of CO2 to Solid Bicarbonate -

    • Principal Investigator
      SHIMAHARA Hideto
    • Project Period (FY)
      2012 – 2014
    • Research Category
      Grant-in-Aid for Scientific Research (C)
    • Research Field
      Environmental chemistry
    • Research Institution
      Japan Advanced Institute of Science and Technology
  •  Theoretical investigaiton for the generation of the properties by the control of spin and geometry of a small number atom containing cluster materials

    • Principal Investigator
      OKUMURA Mitsutaka
    • Project Period (FY)
      2011 – 2013
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      Functional materials chemistry
    • Research Institution
      Osaka University
  •  Theoretical studies on possibility of the entrainment in molecular systemsPrincipal Investigator

    • Principal Investigator
      NAGAO Hidemi
    • Project Period (FY)
      2011 – 2012
    • Research Category
      Grant-in-Aid for Challenging Exploratory Research
    • Research Field
      Polymer chemistry
    • Research Institution
      Kanazawa University
  •  Mathematical approach to the bacterial colony pattern formation by the introduction of the many particles model

    • Principal Investigator
      NAGAYAMA Masaharu
    • Project Period (FY)
      2010 – 2011
    • Research Category
      Grant-in-Aid for Challenging Exploratory Research
    • Research Field
      General mathematics (including Probability theory/Statistical mathematics)
    • Research Institution
      Kanazawa University
  •  タンパク質複合体の構造安定性とダイナミックスに関する理論的研究Principal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      2008 – 2009
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas
    • Review Section
      Science and Engineering
    • Research Institution
      Kanazawa University
  •  タンパク質複合体構造とダイナミックスの理論的研究Principal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      2007
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas
    • Review Section
      Science and Engineering
    • Research Institution
      Kanazawa University
  •  Light-Induced Electron Dynamics of Molecules : Development of Electron Dynamics Methods and Calculation of Photoelectron Spectra

    • Principal Investigator
      KONO Hirohiko
    • Project Period (FY)
      2007 – 2008
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      Physical chemistry
    • Research Institution
      Tohoku University
  •  Theoretical Investigation of Macroscopic Magnetism for Molecular Magnets using Statistical Theory and ab initio calculations

    • Principal Investigator
      OKUMURA Mitsutaka
    • Project Period (FY)
      2007 – 2010
    • Research Category
      Grant-in-Aid for Scientific Research (B)
    • Research Field
      Functional materials chemistry
    • Research Institution
      Osaka University
  •  NMR and MM Analysis of Tautomerization of His64 Coupled to Ionization of Zinc-bound Solvent during Proton Transfer in Carbonic Anhydrase

    • Principal Investigator
      SHIMAHARA Hideto
    • Project Period (FY)
      2007 – 2008
    • Research Category
      Grant-in-Aid for Young Scientists (B)
    • Research Field
      Biophysics
    • Research Institution
      Japan Advanced Institute of Science and Technology
  •  Development of simulation methods for materials synthesis under high pressure

    • Principal Investigator
      NAGARA Hitose
    • Project Period (FY)
      2005 – 2008
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas
    • Review Section
      Science and Engineering
    • Research Institution
      Osaka University
  •  レーザー照射による結晶の物性発現と制御に関する理論的研究Principal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      2004 – 2005
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas
    • Review Section
      Science and Engineering
    • Research Institution
      Kanazawa University
  •  結晶におけるレーザー照射による物性発現と制御に関する理論的研究Principal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      2003
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas
    • Review Section
      Science and Engineering
    • Research Institution
      Kanazawa University
  •  THEORETICAL STUDIES ON MANY-BAND EFFECTS ON SUPERCONDUCTIVITY AND MAGNETISM IN MOLECULAR CRYSTALSPrincipal Investigator

    • Principal Investigator
      NAGAO Hidemi
    • Project Period (FY)
      2003 – 2004
    • Research Category
      Grant-in-Aid for Scientific Research (C)
    • Research Field
      Physical chemistry
    • Research Institution
      KANAZAWA UNIVERSITY
  •  Development of time-dependent density functional theory for electronic and nuclear degrees of freedom : Investigation of structural deformation of molecules in intense laser fields

    • Principal Investigator
      KONO Hirohiko
    • Project Period (FY)
      2002 – 2003
    • Research Category
      Grant-in-Aid for Scientific Research (C)
    • Research Field
      Physical chemistry
    • Research Institution
      Tohoku University
  •  有機分子性結晶の外場誘導超伝導発現の理論的研究Principal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      2001 – 2002
    • Research Category
      Grant-in-Aid for Young Scientists (B)
    • Research Field
      Physical chemistry
    • Research Institution
      Kanazawa University
  •  スピン共役電子系の理論計算Principal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      2000
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas (A)
    • Research Institution
      Kanazawa University
  •  核と電子を等価に扱う密度汎関数理論とダイナミックスPrincipal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      2000 – 2001
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas (A)
    • Review Section
      Science and Engineering
    • Research Institution
      Kanazawa University
  •  スピン共役電子系の理論計算Principal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      1999
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas (A)
    • Research Institution
      Osaka University
  •  スピン共役電子系の理論計算Principal Investigator

    • Principal Investigator
      長尾 秀実
    • Project Period (FY)
      1998
    • Research Category
      Grant-in-Aid for Scientific Research on Priority Areas (A)
    • Research Institution
      Osaka University

All 2024 2023 2018 2017 2016 2015 2014 2013 2012 2011 2010 2009 2008 2007 2006 2005 2004 2003 Other

All Journal Article Presentation Book

  • [Book] NATO Science Series, II Mathematics, Physics and Chemistry(Kondo effect coupled to superconductivity in ultrasmall grains)2008

    • Author(s)
      H., Nagao・S.P.Kruchinin
    • Publisher
      Kluwer Academic Publishers(印刷中)
    • Data Source
      KAKENHI-PROJECT-17064013
  • [Book] 1.4 Multi-Gap Superconductivity in MgB2", in "Symmetry and Heterogeneity in High Temperature Superconductors [Springer, NATO Science Series II : Mathematics, Physics and Chemistry -Vol.214, Dordrecht/Boston/London](Edited by A.Bianconi)2006

    • Author(s)
      S.P.Kruchinin, H.Nagao
    • Publisher
      Kluwer Academic Publishers
    • Data Source
      KAKENHI-PROJECT-17064013
  • [Book] ASI Series Vol. "Symmetry and Heterogeneity in High Temperature Superconductors" (Editor A.Bianconi) (Multi-gap superconductivity in MgB_2)2005

    • Author(s)
      S.P.Kruchinin, H.Nagao
    • Publisher
      Kluwer Academic Publishers(in press)
    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Book] 物性量子化学入門2004

    • Author(s)
      山口兆, 吉岡泰規, 中野雅由, 長尾秀実, 奥村光隆 編
    • Total Pages
      288
    • Publisher
      講談社サイエンティフィク
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Book] 「物性量子化学入門」第7章2004

    • Author(s)
      山口兆, 吉岡泰規, 中野雅由, 長尾秀実, 奥村光隆
    • Publisher
      編講談社サイエンティフィク
    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Book] Bussei Ryousikagaku Nyumon (Japanese)2004

    • Author(s)
      K.Yamaguchi, Y.Yoshioka, M.Nakano, H.Nagao, M.Okumura
    • Publisher
      Kodannsya Scientific
    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Book] Models and Methods of High-Tc Superconductivity -Some Frontal Aspects- Volume 1 Volume 241 in Horizons in World Physics (edited by J.K.Srivastava, S.M.Rao) ((2003) Chapter 6, "Multizone superconductivity")2003

    • Author(s)
      H.Nagao, S.P.Kruchinin, K.Yamaguchi
    • Publisher
      Horizons in World Physics
    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Book] "Multizone superconductivity" Models and Methods of High-Tc Superconductivity -Some Frontal Aspects-Volume 1 Volume 241(edited by J.K.Srivastava, S.M.Rao) Chapter 62003

    • Author(s)
      H.Nagao, S.P.Kruchinin, K.Yamaguchi
    • Publisher
      Horizons in World Physics
    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Book] "Multi-gap superconductivity in MgB_2" ASI Series Vol."Symmetry and Heterogeneity in High Temperature Superconductors"(Editor A.Bianconi)

    • Author(s)
      S.P.Kruchinin, H.Nagao
    • Publisher
      Kluwer Academic Publishers(in press.)
    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] All-atom molecular dynamics simulations and infrared spectral analysis of myosin2024

    • Author(s)
      Lilih Siti Solihat, Kazutomo Kawaguchi, Hidemi Nagao
    • Journal Title

      Science Report in Kanazawa University

      Volume: 67 Pages: 41-56

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23K03338
  • [Journal Article] Theoretical studies on association/dissociation process of plastocyanin and cytochrome f in photosynthesis2018

    • Author(s)
      Isman Kurniawan, Takahiro Matsui, Satoshi Nakagawa, Kazutomo Kawaguchi, Hidemi Nagao
    • Journal Title

      Journal of Physics: Conference Series

      Volume: 印刷中

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Journal Article] Molecular dynamics study of binary POPC bilayers: molecular condensing effects on membrane structure and dynamics2018

    • Author(s)
      Hiroaki Saito, Tetsuya Morishita, Taku Mizukami, Ken-ichi Nishiyama, Kazutomo Kawaguchi, Hidemi Nagao
    • Journal Title

      Journal of Physics: Conference Series

      Volume: 印刷中

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Journal Article] Theoretical study on interaction of cytochrome f and plastocyanin complex by a simple coarse-grained model with molecular crowding effect2018

    • Author(s)
      Satoshi Nakagawa, Isman Kurniawan, Koichi Kodama, Muhammad Saleh Arwansyah, Kazutomo Kawaguchi, Hidemi Nagao
    • Journal Title

      Molecular Physics

      Volume: 印刷中

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Journal Article] A coarse-grained model of the effective interaction for charged amino acid residues and its application to formation of GCN4-pLI tetramer2018

    • Author(s)
      Kazutomo Kawaguchi, Satoshi Nakagawa, Isman Kurniawan, Koichi Kodama, Muhammad Saleh Arwansyah, Hidemi Nagao
    • Journal Title

      Molecular Physics

      Volume: 印刷中

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Journal Article] Effect of Hydrophilic Residues and Hydrophobic Length on Flip-Flop Promotion by Transmembrane Peptides2018

    • Author(s)
      Hiroyuki Nakao, Chihiro Hayashi, Keisuke Ikeda, Hiroaki Saito, Hidemi Nagao, Minoru Nakano
    • Journal Title

      The Journal of Physical Chemistry B

      Volume: 印刷中

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Journal Article] A simple coarse-grained model for interacting protein complex2017

    • Author(s)
      Kazutomo Kawaguchi, Satoshi Nakagawa, Shogo Kinoshita, Makoto Wada, Hiroaki Saito, Hidemi Nagao
    • Journal Title

      Molecular Physics

      Volume: 115 Issue: 5 Pages: 587-597

    • DOI

      10.1080/00268976.2016.1234652

    • Peer Reviewed / Acknowledgement Compliant
    • Data Source
      KAKENHI-PROJECT-16K05648, KAKENHI-PROJECT-26400429
  • [Journal Article] Dual function of coronatine as a bacterial virulence factor against plants: possible COI1-JAZ- independent role2016

    • Author(s)
      Syusuke Egoshi,Yousuke Takaoka, Hiroaki Saito, Yuuki Nukadzuka, Kengo Hayashi, Yasuhiro Ishimaru, Hiroyuki Yamakoshi, Kosuke Dodo, Mikiko Sodeoka and Minoru Ueda
    • Journal Title

      RSC Adv.

      Volume: 6 Issue: 11 Pages: 19404-19412

    • DOI

      10.1080/08927022.2015.1102249

    • Peer Reviewed / Acknowledgement Compliant
    • Data Source
      KAKENHI-PUBLICLY-26102722, KAKENHI-PROJECT-26400429
  • [Journal Article] Decomposition analysis of free energy profile for Hsp90-ADP association2016

    • Author(s)
      Kazutomo Kawaguchi, Hiroaki Saito, Hidemi Nagao
    • Journal Title

      Molecular Simulation

      Volume: 未定

    • Peer Reviewed / Acknowledgement Compliant
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Journal Article] A hybrid-type approach with MD and DFT calculations for evaluation of redox potential of molecules2015

    • Author(s)
      Masashi Iwayama, Isman Kurniawan , Kazutomo Kawaguchi , Hiroaki Saito and Hidemi Nagao
    • Journal Title

      Molecular Simulation

      Volume: 41 Issue: 10-12 Pages: 936-941

    • DOI

      10.1080/08927022.2015.1012641

    • Peer Reviewed
    • Data Source
      KAKENHI-PUBLICLY-26102722, KAKENHI-PROJECT-26400429
  • [Journal Article] Analysis of water molecules around GTP in Hras-GTP complex and GDP in Hras-GDP complex by molecular dynamics simulations2014

    • Author(s)
      T. Miyakawa
    • Journal Title

      MOLECULAR PHYSICS

      Volume: 112 Issue: 3-4 Pages: 526-532

    • DOI

      10.1080/00268976.2013.852697

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23350064, KAKENHI-PROJECT-23750008, KAKENHI-PROJECT-24540442, KAKENHI-PUBLICLY-26102722, KAKENHI-PROJECT-26400429
  • [Journal Article] Network of water molecules around guanine nucleotide in the Hras-GTP and -GDP complexes by MD simulations2014

    • Author(s)
      Takeshi Miyakawa, Ryota Morikawa, Masako Takasu, Kimikazu Sugimori, Tomokazu Kawaguchi, Hiroaki Saito, Hidemi Nagao
    • Journal Title

      JPS Conf. Proc.

      Volume: volume 1 Pages: 16006-16006

    • DOI

      10.7566/jpscp.1.016006

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23750008, KAKENHI-PROJECT-24540442, KAKENHI-PROJECT-26400429
  • [Journal Article] Molecular Dynamics Study of Hsp90 and ADP: Hydrogen Bond Analysis for ADP Dissociation2014

    • Author(s)
      Kazutomo KAWAGUCHI, Hiroaki SAITO, Hidemi NAGAO
    • Journal Title

      JPS Conf. Proc.

      Volume: volume 1 Pages: 012056-012056

    • DOI

      10.7566/jpscp.1.012056

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23750008, KAKENHI-PROJECT-26400429
  • [Journal Article] Molecular Dynamics Study of Gramicidin A in Lipid Bilayer: Electrostatic Map and Ion Conduction2014

    • Author(s)
      Hiroaki SAITO, Masashi IWAYAMA, Kazutomo KAWAGUCHI, Taku MIZUKAMI, Takeshi MIYAKAWA, Masako TAKASU, and Hidemi NAGAO
    • Journal Title

      JPS Conf. Proc

      Volume: volume 1 Pages: 012053-012053

    • DOI

      10.7566/jpscp.1.012053

    • Peer Reviewed / Open Access
    • Data Source
      KAKENHI-PROJECT-23750008, KAKENHI-PROJECT-25650050, KAKENHI-PROJECT-26400429
  • [Journal Article] Π-stacking Interaction between Heterocyclic Rings in a Reaction Field of Biological System2014

    • Author(s)
      Muhamad KOYIMATU, Hideto SHIMAHARA, Kimikazu SUGIMORI, Kazutomo KAWAGUCHI, Hiroaki SAITO, and Hidemi NAGAO
    • Journal Title

      JPS Conf. Proc.

      Volume: volume 1

    • DOI

      10.7566/jpscp.1.012055

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23750008, KAKENHI-PROJECT-24550173
  • [Journal Article] 生体高分子の触媒科学-金属含有蛋白質のプロトン輸送の機構解明-2014

    • Author(s)
      島原秀登,Muhamad Koyimatu,杉森公一,長尾秀実
    • Journal Title

      北陸先端科学技術大学院大学共有計算サーバ使用成果報告2013

      Volume: IS-TM-2014-001 Pages: 34-34

    • Acknowledgement Compliant / Open Access
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Journal Article] Theoretical Model for Assessing Properties of Local Structures in Metalloprotein2013

    • Author(s)
      Muhamad Koyimatu, Hideto Shimahara, Masashi Iwayama, Kimikazu Sugimori, Kazutomo Kawaguchi, Hiroaki Saito, Hidemi Nagao
    • Journal Title

      AIP Conf. Proc.

      Volume: 1518 Pages: 626-629

    • DOI

      10.1063/1.4794647

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23750008, KAKENHI-PROJECT-24550173
  • [Journal Article] Theoretical Study on Entrainment Phenomenon in Model Molecular Systems2013

    • Author(s)
      H. Nagao, S. Kawamoto, M. Rusmerryani, A. Purqon, K. Kawaguchi, H. Saito
    • Journal Title

      AIP Conference Proceedings

      Volume: 1518 Pages: 729-732

    • DOI

      10.1063/1.4794669

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101, KAKENHI-PROJECT-23750008
  • [Journal Article] An Approach to Water Molecule Dynamics Associated with Motion of Catalytic Moiety2013

    • Author(s)
      Hideto Shimahara*, Kimikazu Sugimori, Muhmad Koyimatu, Hidemi Nagao, Tadayasu Ohkubo, and Yuji Kobayashi
    • Journal Title

      AIP Conf. Proc.

      Volume: 1518 Pages: 610-613

    • DOI

      10.1063/1.4794643

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Journal Article] Molecular Dynamics Analyses of the Dissociation Process of ADP from Hsp902012

    • Author(s)
      K. Kawaguchi, H. Takagi, M. Iwayama, M.Nishimura, T. Miyakawa, H. Saito, M. Takasu, H.Nagao
    • Journal Title

      International Journal of Quantum Chemistry

      Volume: 112 Issue: 24 Pages: 3791-3795

    • DOI

      10.1002/qua.24229

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101, KAKENHI-PROJECT-23750008
  • [Journal Article] Molecular Dynamics Studies of Lipid Bilayer with Gramicidin A: Effects of Gramicidin A on Membrane Structure and Hydrophobic Match2012

    • Author(s)
      Hiroaki Saito, Taku Mizukami, Shuhei Kawamoto, Takeshi Miyakawa, Masashi Iwayama, Masako Takasu, Hidemi Nagao
    • Journal Title

      International Journal of Quantum Chemistry

      Volume: 112 Issue: 1 Pages: 161-170

    • DOI

      10.1002/qua.23252

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101, KAKENHI-PROJECT-23750008
  • [Journal Article] Molecular Dynamics Study of Gramicidin A in Lipid Bilayer: Structure and Lateral Pressure Profile2012

    • Author(s)
      H. Saito, M. Iwayama, H. Takagi, M. Nishimura, T. Miyakawa, K. Kawaguchi, M. Takasu, T. Mizukami, H. Nagao
    • Journal Title

      International Journal of Quantum Chemistry

      Volume: 112 Issue: 24 Pages: 3834-3839

    • DOI

      10.1002/qua.24248

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101, KAKENHI-PROJECT-23750008
  • [Journal Article] Solvation effect on the structural change of globular protein: a molecular dynamics study2012

    • Author(s)
      Taku Mizukami, Hiroaki Saito, Shuhei Kawamoto, Takeshi Miyakawa, Masako Takasu, Hidemi Nagao
    • Journal Title

      International Journal of Quantum Chemistry

      Volume: 112 Pages: 344-350

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Journal Article] Cell penetrating peptide induces various deformations of lipid bilayer membrane: inverted micelle, double bilayer and trans-membrane2012

    • Author(s)
      Shuhei Kawamoto, Takeshi Miyakawa, Masako Takasu, Ryota Morikawa, Tatsuki Oda, Hiroaki Saito, Shiroh Futaki, Hidemi Nagao
    • Journal Title

      International Journal of Quantum Chemistry

      Volume: 112 Pages: 178-183

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Journal Article] Solvation Effect on the Structural Change of Globular Protein: A Molecular Dynamics Study2012

    • Author(s)
      Taku Mizukami, Hiroaki Saito, Shuhei Kawamoto,Takeshi Miyakawa, Masashi Iwayama, Masako Takasu, Hidemi Nagao
    • Journal Title

      International Journal of Quantum Chemistry

      Volume: 112 Issue: 1 Pages: 344-350

    • DOI

      10.1002/qua.23251

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101, KAKENHI-PROJECT-23750008
  • [Journal Article] Binding of Tat peptides on DOPC and DOPG lipid bilayer membrane studied by molecular dynamicssimulations2012

    • Author(s)
      Shuhei Kawamoto, Masako Takasu, Takeshi Miyakawa, Ryota Morikawa, Tatsuki Oda, Shiroh Futaki, Hidemi Nagao
    • Journal Title

      Molecular Simulation

      Volume: 38 Issue: 5 Pages: 366-368

    • DOI

      10.1080/08927022.2010.536546

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Journal Article] Nanoscale Superconductivity2012

    • Author(s)
      Sergei P. Kruchinin, Hidemi Nagao
    • Journal Title

      International Journal Modern Physics

      Volume: 26 Issue: 26 Pages: 12300013-12300013

    • DOI

      10.1142/s0217979212300137

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Journal Article] Molecular Dynamics Study on Binding Free Energy of Azurin-Cytochrome c551 Complex2012

    • Author(s)
      H. Saito, M. Iwayama, T. Mizukami, J. Kang, M.Tateno, H. Nagao
    • Journal Title

      Chemical Physics Letters

      Volume: 556 Pages: 297-302

    • DOI

      10.1016/j.cplett.2012.12.016

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101, KAKENHI-PROJECT-23750008
  • [Journal Article] Cell-Penetrating Peptide Induces Various Deformations of Lipid Bilayer Membrane: Inverted Micelle,Double Bilayer, and Transmembrane2012

    • Author(s)
      Shuhei Kawamoto, Takeshi Miyakawa, Masako Takasu, Ryota Morikawa, Tatsuki Oda, Shiroh Futaki, Hidemi Nagao
    • Journal Title

      International Journal of Quantum Chemistry

      Volume: 112 Issue: 1 Pages: 178-183

    • DOI

      10.1002/qua.23177

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101, KAKENHI-PROJECT-23750008
  • [Journal Article] Molecular dynamics studies of lipid bilayer with gramicidin A: effects of gramicidin A on membrane structure and hydrophobic match2012

    • Author(s)
      Hiroaki Saito, Taku Mizukami, Shuhei Kawamoto, Takeshi Miyakawa, Masashi Iwayama, Masako Takasu, Hidemi Nagao
    • Journal Title

      International Journal of Quantum Chemistry

      Volume: 112 Pages: 161-170

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Journal Article] Inverted Micelle Formation of Cell-Penetrating Peptide Studied by Coase-grained Simulation: Importance of Attractive Force between Cell-Penetrating Peptides and Lipid Head Group2011

    • Author(s)
      Shuhei Kawamoto, Masako Takasu, Takeshi Miyakawa, Ryota Morikawa, Tatsuki Oda, Shiroh Futaki, Hidemi Nagao
    • Journal Title

      Journal of Chemical Physics

      Volume: 134

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Journal Article] Hydration property of globular proteins : An analysis of solvation free energy by energy representation method2010

    • Author(s)
      H.Saito, N.Matsubayashi, K.Nishikawa, H.Nagao
    • Journal Title

      Chemical Physics Letters

      Volume: 497 Pages: 218-222

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19350070
  • [Journal Article] Effects of Salty Water and Temperature on Shape Fluctuations of a Few Correlated Phospholipids2009

    • Author(s)
      A.Purqon, T.Yamamot, K.Nishikawa, H.Nagao, K.Nishikawa
    • Journal Title

      Prog.Theore.Phys.Supp 178

      Pages: 187-192

    • NAID

      110007225662

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-20038018
  • [Journal Article] Effects of Salty Water and Temperature on Shape Fluctuations of a Few Correlated Phospholipids2009

    • Author(s)
      APurqon, T. Yamamot, K. Nishikawa, H. Nagao, K. Nishikawa
    • Journal Title

      Prog. Theore. Phys. Supp 178

      Pages: 187-192

    • NAID

      110007225662

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-20038018
  • [Journal Article] In silico and in vitro Approaches to Elucidate the Thermal Stability of Human UDP-glucuronosyltransferase(UGT)1A92009

    • Author(s)
      R.Fujiwara, M.Nakajima, T.Yamamoto, H.Nagao, T.Yokoi
    • Journal Title

      Drug Metab. Pharmacokinet 24

      Pages: 235-244

    • NAID

      130004463070

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-20038018
  • [Journal Article] Fuzzy Cluster Modes in Micellar Dynamics2009

    • Author(s)
      A.Purqon, H.Nagao
    • Journal Title

      Journal of Molecular Liquids 147

      Pages: 17-23

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-20038018
  • [Journal Article] Geometrical Classification of Spagetti-like Nanoclusters2008

    • Author(s)
      A. Purqon, A. Sugiyama, H. Nagao, M. Takasu, K. Nishikawa
    • Journal Title

      AIP Conference Proceedings 982

      Pages: 331-336

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19029014
  • [Journal Article] Free Energy Calculation of Docking Structure of Azurin(I)-Cytochrome c551(III)Complex Systems by using The Energy Representation2008

    • Author(s)
      K. Nishikawa, T. Yamamoto, A. Sugiyama, A. Purqon, T. Mizukami, H. Shimahara, H. Nagao, K. Nishikawa
    • Journal Title

      AIP Conference Proceedings 982

      Pages: 780-783

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-20038018
  • [Journal Article] 生物系のプロトントランスファ2008

    • Author(s)
      島原秀登, 長尾秀実
    • Journal Title

      化学(執筆依頼) 63巻

      Pages: 64-65

    • Data Source
      KAKENHI-PROJECT-19770128
  • [Journal Article] Theoretical Study of Free Energy in Docking Stability of Azurin(II)-Cytochrome c551(II) Complex System2008

    • Author(s)
      山本哲徳, 水上卓, 島原秀登, 長尾秀実, (他4名, 6番目)
    • Journal Title

      AIP Conference Proceedings 982巻

      Pages: 784-787

    • Data Source
      KAKENHI-PROJECT-19770128
  • [Journal Article] Free Energy Calculation of Docking Structure of Azurin(I)-Cyto- chrome c551(III) Complex Systems by using the Energetic Representation2008

    • Author(s)
      西川佳吾, 水上卓, 島原秀登, 長尾秀実, (他4名, 6番目)
    • Journal Title

      AIP Conference Proceedings 982巻

      Pages: 780-783

    • Data Source
      KAKENHI-PROJECT-19770128
  • [Journal Article] Theoretical Study of Free Energy in Docking Stability of Azurin (II)-Cytochrome c551 (II) Complex System2008

    • Author(s)
      T. Yamamoto, K. Nishikawa, A. Sugiyama, A. Purqon, T. Mizukami, H. Shimahara, H. Nagao, K. Nishikawa
    • Journal Title

      AIP Conference Proceedings 982

      Pages: 784-787

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19029014
  • [Journal Article] Tautomerism of histidine 64 associated with proton transfer in catalysis of Carbonic Anhydrase2008

    • Author(s)
      島原秀登, 吉田卓也, 水上卓, 中沢隆, 長尾秀実, 大久保忠恭, 小林祐次, (他2名, 1番目)
    • Journal Title

      FASEB Journal 22巻

    • Data Source
      KAKENHI-PROJECT-19770128
  • [Journal Article] Theoretical Study of Free Energy in Docking Stability of Azurin(II)-Cytochrome c551(II)Complex System2008

    • Author(s)
      T. Yamamot, K. Nishikawa, A. Sugiyama, A. Purqon, T. Mizukami, H. Shimahara, H. Nagao, K. Nishikawa
    • Journal Title

      AIP Conference Proceedings 982

      Pages: 784-787

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-20038018
  • [Journal Article] Aperture, symmetry, isotropy, and compactness analysis and their correlation in spaghetti-like nanostructure dynamics2007

    • Author(s)
      A. Purqon, A. Sugiyama, H. Nagao, K. Nishikawa
    • Journal Title

      Chemical Physics Letters 443

      Pages: 356-363

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-19029014
  • [Journal Article] Oxygen at High Pressures: Theoretical Approach to Monoatomic Phases2007

    • Author(s)
      T., Oda・K., Sugimori・H., Nagao・I., Hamada・S., Kagayama・M., Geshi・H., Nagara・K., Kusakabe・N., Suzuki
    • Journal Title

      J.Phys.:Condens.Matter 19

    • NAID

      120001130423

    • Peer Reviewed
    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Electronic structure of Pt clusters adsorbed on (5,5) singe wall carbon nanotube2006

    • Author(s)
      H.C.Dam, T.C.Nguyen, A.T.Nguyen, Y-T.Kim, T.B.Ho, T.Mitani, T.Ozaki, H.Nagao
    • Journal Title

      Chem. Phys. Lett. 432

      Pages: 213-213

    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Theoretical studies of the effect of pair scattering process on two-gap superconductivity in Eliashberg theory2006

    • Author(s)
      H.Nagao, H.Kawabe
    • Journal Title

      Int. J. Quantum Chem. 106

      Pages: 3048-3048

    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Theoretical study of multiphoton processes in diatomic molecules2005

    • Author(s)
      K.Sugimori, T.Ito, H.Nagao, K.Nishikawa
    • Journal Title

      Int.J.Quantum Chem. 105

      Pages: 596-604

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Laser control of proton motion in porphyrin derivative2005

    • Author(s)
      K.Nishikawa, T.Ito, K.Sugimori, Y.Ohta, H.Nagao
    • Journal Title

      International Journal of Quantum Chemistry 102

      Pages: 665-672

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Two-gap superconductivity in MgB_22005

    • Author(s)
      Sergei, P.Kuruchinin, H.Nagao
    • Journal Title

      Physics Particle Nuclei 36 Suppl

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Electronic structure and magnetism at the active site in ferredoxin : ab initio approach to (Fe2S2) 2+ complex with the 1st peptide shell2005

    • Author(s)
      T.Oda, H.Nagao, A.Sugiyama, K.Wada
    • Journal Title

      Polyhedron 24

      Pages: 2550-2556

    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Spin susceptibility in many-band system2005

    • Author(s)
      H.Nagao
    • Journal Title

      Polyhedron 24

      Pages: 2389-2395

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Spin Susceptibility in Many-band System2005

    • Author(s)
      H.Nagao
    • Journal Title

      Polyhedron (in press)

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical studies on effective interactions in two-band system2005

    • Author(s)
      H.Nagao, H.Kawabe
    • Journal Title

      International Journal of Quantum Chemistry 105

      Pages: 571-579

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Spin susceptibility in many-band system2005

    • Author(s)
      H.Nagao
    • Journal Title

      Polyhedron 24

      Pages: 2389-2395

    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Theoretical studies on effective interactions in two-band system2005

    • Author(s)
      H.Nagao, H.Kawabe
    • Journal Title

      Int.J. Quantum Chem. 105

    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Two-gap superconductivity in MgB22005

    • Author(s)
      S.P.Kruchinin, H.Nagao
    • Journal Title

      Particle Nuclei, Suppl. 36

    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Search for the ground states of Ising spin clusters by using the genetic algorithms2005

    • Author(s)
      A.Oda, H.Nagao, Y.Kitagawa, Y.Shigeta, M.Shoji, H.Nitta, M.Okumura, K.Yamaguchi
    • Journal Title

      Int.J. Quantum Chem. 105

      Pages: 645-654

    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Laser control of singlet-triplet transition in molecules2005

    • Author(s)
      T.Ito, K.Sugimori, H.Nagao, K.Nishikawa
    • Journal Title

      Polyhedron 24

      Pages: 2726-2731

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Formulation of unrestricted and restricted Hartree-Fock-Bogoliubov equations2004

    • Author(s)
      D.Yamaki, T.Ohsaku, H.Nagao, K.Yamaguchi
    • Journal Title

      Int.J.Quamtum Chem. 96

      Pages: 10-16

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Formulation of unrestricted and restricted Hartree-Fock-Bogoliubov equation2004

    • Author(s)
      D.Yamaki, T.Ohsaku, H.Nagao, K.Yamaguchi
    • Journal Title

      International Journal of Quantum Chemistry 96

      Pages: 10-16

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Laser control of non-stationary proton state in hydrogen-bonded system2004

    • Author(s)
      T.Yamaguchi, I.Sakamoto, Y.Ohta, H.Nagao, K.Nishikawa
    • Journal Title

      AIP conference proceedings 708

      Pages: 787-788

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Possibility of superconductivity in intercalation compound related to MgB_22004

    • Author(s)
      N.Kato, H.Nagao, K.Nishikawa, K.Nishidate, K.Endo
    • Journal Title

      International Journal of Quantum Chemistry 96

      Pages: 457-462

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical study on photoexcited states of strongly correlated electron systems2004

    • Author(s)
      K.Sugiyama, T.Yamaguchi, I.Sakamoto, T.Yoshimoto, H.Nagao, K.Nishikawa
    • Journal Title

      AIP conference proceedings 708

      Pages: 753-754

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] J-model for magnetism and superconductivity of triangular, Kagome, and related spin lath'ce systems2004

    • Author(s)
      S.Yamanaka, D.Yamaki, R.Takeda, H.Nagao, K.Yamaguchi
    • Journal Title

      International Journal of Quantum Chemistry 100

      Pages: 1179-1196

    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Possibility of superconductivity in intercalation compound related to MgB_22004

    • Author(s)
      N.Kato, H.Nagao, K.Nishikawa, K.Nishidate, K.Endo
    • Journal Title

      Int.J.Quantum Chem. 96

      Pages: 457-462

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical Studies on Electronic States of Rh-C60. Possibility of a Room-temperature Organic Ferromagnet2004

    • Author(s)
      S.Nakano, Y.Kitagawa, T.Kawakami, M.Okumura, H.Nagao, K.Yamaguchi
    • Journal Title

      Molecules 9

      Pages: 792-807

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] A formulation and numerical approach to molecular systems by the Green function method without Born-Oppenheimer approximation II2004

    • Author(s)
      T.Ito, T.Yoshimoto, Y.Ohta, H.Kawabe, H.Nagao, K.Nishikawa
    • Journal Title

      International Journal of Quantum Chemistry 100

      Pages: 918-926

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Theoretical study on photoexcited state of strongly correlated electron systems2004

    • Author(s)
      K.Sugiyama, T.Yamaguchi, I.Sakamoto, T.Yoshimoto, H.Nagao, K.Nishikawa
    • Journal Title

      AIP conference proceedings 708

      Pages: 753-754

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Theoretical studies on many-band effects in magnetism and superconductivity2004

    • Author(s)
      H.Nagao
    • Journal Title

      International Journal of Quantum Chemistry 100

      Pages: 867-876

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Theoretical studies on many-band effects in magnetism and superconductivity2004

    • Author(s)
      H.Nagao
    • Journal Title

      Int.J.Quantum Chem. 100

      Pages: 867-876

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical studies on photoeacited state of strongly correlated electron systems2004

    • Author(s)
      K.Sugiyama, T.Yamaguchi, I.Sakamoto, T.Yoshimoto, H.Nagao, K.Nishikawa
    • Journal Title

      AIP conference proceedings 708

      Pages: 753-754

    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] J-Model for Magnetism and Superconductivity of Triangular, Kagome, and Related Spin Lattice Systems2004

    • Author(s)
      S.Yamanaka, D.Yamaki, R.Takeda, H.Nagao, K.Yamaguchi
    • Journal Title

      Int.J.Quamtum Chem. 100

      Pages: 1179-1196

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] J-Model for Magnetism and Superconductivity of Triangular, Kagome, and Relaed Spin Lattice Systems2004

    • Author(s)
      S.Yamanaka, D.Yamaki, R.Takeda, H.Nagao, K.Yamaguchi
    • Journal Title

      International Journal of Quantum Chemistry 100

      Pages: 1179-1196

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical studies on electronic states of Rh-C_<60>.Possibility of a room-temperature organic ferromagnet2004

    • Author(s)
      S.Nakano, Y.Kitagawa, T.Kawakami, M.Okumura, H.Nagao, K.Yamaguchi
    • Journal Title

      Molecules 9

      Pages: 792-807

    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical studies on many-band effects in magnetism and superconductivity2004

    • Author(s)
      H.Nagao
    • Journal Title

      International Journal of Quantum Chemistry 100

      Pages: 867-876

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] N-band Hubbard models II : Cooperative mechanisms of electron-phonon, Electron correlation, and many-band effects toward high-Tc superconductors2003

    • Author(s)
      K.Yamaguchi, D.Yamaki, Y.Kitagawa, M.Takahata, T.Kawakami, T.Ohsaku, H.Nagao
    • Journal Title

      International Journal of Quantum Chemistry 92

      Pages: 47-70

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Spin and pseudo spins in theoretical chemistry. A unified view for superposed and entangled quantum systems2003

    • Author(s)
      K.Yamaguchi, M, Nakano, H.Nagao, M.Okumura, S.Yamanaka, T.Kawakami, D.Yamaki, M.Nishino, Y.Shigeta, Y.Kitagawa, Y.Takano, M.Takahata, R.Takeda
    • Journal Title

      B.Kor.Chem.Soc. 24(6)

      Pages: 864-880

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Superconductivity in two-band model by re normalization group approach2003

    • Author(s)
      H.Nagao, H.Kawabe, S.P.Kruchinin, K.Yamaguchi
    • Journal Title

      Int.J.Mod.Phys. B17

      Pages: 3373-3376

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Multizone superconductivity2003

    • Author(s)
      H.Nagao, S.P.Kruchinin, K.Yamaguchi
    • Journal Title

      Models and Methods of High-Tc Superconductivity -Some Frontal Aspects-(Horizons in World Physics) (edited by J.K.Srivastava, S.M.Rao) Volume I Volume 241 Chapter 6

      Pages: 206-214

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical studies on many-band effects in superconductivity by using renoemalization group approach2003

    • Author(s)
      H.Nagao, H.Kawabe, S.P.Kruchinin, D.Manske, K.Yamaguchi
    • Journal Title

      Modern Physics Letters B17

      Pages: 423-431

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical studies on superconductivity by using the mean-field approximation2003

    • Author(s)
      T.Yoshimoto, A.Sugiyama, K.Sugiyama, H.Nagao, K.Nishikawa
    • Journal Title

      Recent Research Developments in Chemical Physics 4

      Pages: 395-420

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Spin and pseudo spins in theoretical chemistry. A unified view for superposed and entangled quantum systems2003

    • Author(s)
      K.Yamaguchi, T.Kawakami, T.Taniguchi, S.Nakano, Y.Kitagawa, M, H.Nagao, T.Ohsaku, R.Takeda
    • Journal Title

      Polyhedron 22

      Pages: 2077-2090

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical studies on many-band effects in superconductivity by using renoemalization group approach2003

    • Author(s)
      H.Nagao, H.Kawabe, S.P.Kruchinin, D.Manske, K.Yamaguchi
    • Journal Title

      Mod.Phys.Lett. B17

      Pages: 423-431

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Spin and pseudo spins in theoretical chemistry. A unified view for superposed and entangled quantum systems2003

    • Author(s)
      K.Yamaguchi, M.Nakano, H.Nagao, M.Okumura, S.Yamanaka, T.Kawakami, D.Yamaki, M.Nishino, Y.Shigeta, Y.Kitagawa, Y.Takano, M.Takahata, R.Takeda
    • Journal Title

      Bull Korean Chemical Society 24

      Pages: 864-880

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Theoretical studies of molecule-based magnetic conductors2003

    • Author(s)
      K.Yamaguchi, T.Kawakami, T.Taniguchi, S.Nakano, Y.Kitagawa, H.Nagao, T.Ohsaku, R.Takeda
    • Journal Title

      Polyhedron 22

      Pages: 2077-2090

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Superconductivity in two-band model by renormalization group approach2003

    • Author(s)
      H.Nagao, H.Kawabe, S.P.Kruchinin, K.Yamaguchi
    • Journal Title

      International Journal of Modern Physics B17

      Pages: 3373-3376

    • Description
      「研究成果報告書概要(和文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] N-band Hubbard models II : Cooperative mechanisms of electron-phonon, Electron correlation, and many-band effects toward high-Tc superconductors2003

    • Author(s)
      K.Yamaguchi, D.Yamaki, Y.Kitagawa, M.Takahata, T.Kawakami, T.Ohsaku, H.Nagao
    • Journal Title

      Int.J.Quantum Chem. 92

      Pages: 47-70

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Spin susceptibility in many-band system

    • Author(s)
      H.Nagao
    • Journal Title

      Polyhedron (in press)

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Oxygen at High Pressures : Theoretical Approach to Monoatomic Phases

    • Author(s)
      T.Oda, K.Sugimori, H.Nagao, I.Hamada, S.Kagayama, M.Geshi, H.Nagara, K.Kusakabe, N.Suzuki
    • Journal Title

      J. Phys. : Condens. Matter (in press)

    • NAID

      120001130423

    • Data Source
      KAKENHI-PROJECT-17064013
  • [Journal Article] Laser control of singlet-triplet transition in molecules

    • Author(s)
      T.Ito, K.Sugimori, H.Nagao, K.Nishikawa
    • Journal Title

      Polyhedron (in press)

    • Data Source
      KAKENHI-PROJECT-16032204
  • [Journal Article] Spin Susceptibility in Many-band System

    • Author(s)
      H.Nagao
    • Journal Title

      Polyhedron (in press)

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Spin susceptibility in many-band system

    • Author(s)
      H.Nagao
    • Journal Title

      Polyhedron in press

    • Data Source
      KAKENHI-PROJECT-15550010
  • [Journal Article] Multi-gap superconductivity in MgB_2

    • Author(s)
      S.P.Kruchinin, H.Nagao
    • Journal Title

      ASI Series Vol. Symmetry and Heterogeneity in High Temperature Superconductors (Editor A.Bianconi) (Kluwer Academic Publishers) (in press)

    • Description
      「研究成果報告書概要(欧文)」より
    • Data Source
      KAKENHI-PROJECT-15550010
  • [Presentation] Theoretical Study of Peak Position in One Dimensional Oscillation Patterns by using Stochastic Simulation2023

    • Author(s)
      R. Imayoshi, K. Kokubo, T. Kawashima, K. Kawaguchi, H. Nagao
    • Organizer
      第61回日本生物物理学会年会
    • Data Source
      KAKENHI-PROJECT-23K03338
  • [Presentation] Theoretical study of the dependence of different lipid types and ratios on the curvature of plant thylakoid membranes2023

    • Author(s)
      K. Kokubo, R. Imayoshi, T. Kawashima, K. Kawaguchi, H. Nagao
    • Organizer
      第61回日本生物物理学会年会
    • Data Source
      KAKENHI-PROJECT-23K03338
  • [Presentation] Theoretical Study of Solvent Effect and Stability of Complex Structure of Aspirin and Hydroxyprophyl-beta-Cyclodextrin by MD Simulation2023

    • Author(s)
      H. Jayyinunnisya, D. Rendrawan, L. Meriko, K. Kawaguchi, H. Nagao
    • Organizer
      第61回日本生物物理学会年会
    • Data Source
      KAKENHI-PROJECT-23K03338
  • [Presentation] 1 次元 Gray-Scott モデルにおける振動パターンの Smoluchowski 拡散方程式によるモテ&#12441;ル化2023

    • Author(s)
      今吉竜汰, 狩俣龍之介, 川口一朋,長尾秀実
    • Organizer
      第37回分子シミュレーション討論会
    • Data Source
      KAKENHI-PROJECT-23K03338
  • [Presentation] Theoretical study of a coarse-grained model for folding and association of a protein complex2018

    • Author(s)
      Kazutomo Kawaguchi, Satoshi Nakagawa, Hidemi Nagao
    • Organizer
      The 58th Sanibel Symposium
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Molecular Dynamics Simulation: The Free Energy Profile for Dissociation of Ligand from CA I Active Site, Theoretical study of a coarse-grained model for folding and association of a protein complex2018

    • Author(s)
      M. S. Arwansyah, I. Kurniawan, K. Kazutomo, and H. Nagao
    • Organizer
      The 58th Sanibel Symposium
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] The Free Energy Profile for Dissociation of Ligand from Zn2+ Ion of CA I Activesite2017

    • Author(s)
      Arwansyah Muhammad Saleh, Isman Kurniawan, Kazutomo Kawaguchi, Hidemi Nagao
    • Organizer
      第55回日本生物物理学会年会
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Goldman-Hodgkin-Katz 方程式から得られる静止膜電位の分子動力学シミュレーション2017

    • Author(s)
      川口一朋、長尾秀実
    • Organizer
      第31 回分子シミュレーション討論会
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] The Exit Pathways of Water Molecule from Tri-Nuclear Copper Center of Multicopper Oxidase: A Steered Molecular Dynamics Study2017

    • Author(s)
      I. Kurniawan, K. Kawaguchi, T. Sakurai, and H. Nagao
    • Organizer
      International Symposium on Computational Science 2017
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical Study on Contribution of Long-Range Interaction to Electronic Structure of Type I Copper Center in Multicopper Oxidase2017

    • Author(s)
      Isman Kurniawan, Koichi Kodama1, Makoto Wada1, Satoshi Nakagawa, Kimikazu Sugimori, Kazutomo Kawaguchi, Takeshi Sakurai, Hidemi Nagao
    • Organizer
      第31 回分子シミュレーション討論会
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study of diffusion of plastocyanin with Langevin dynamics simulation2017

    • Author(s)
      Makoto Wada, Satoshi Nakagawa, Kazutomo Kawaguchi, Hidemi Nagao
    • Organizer
      International Symposium on Computational Science 2017
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Development of a coarse-grained model for charged amino acid residues2017

    • Author(s)
      K. Kawaguchi, S. Nakagawa, H. Nagao
    • Organizer
      第55回日本生物物理学会年会
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical studies on dynamics of electron carriers in photosynthesis2017

    • Author(s)
      Hidemi Nagao, Satoshi Nakagawa, Isman Kurniawan, Koichi Kodama, Muhammad Arwansyah, Kazutomo Kawaguchi
    • Organizer
      第55回日本生物物理学会年会
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study on contribution of screened electrostatic intermolecular interaction to reaction process of Plastocyanin and Cytochrome f2017

    • Author(s)
      Satoshi Nakagawa, Kazutomo Kawaguchi, Hidemi Nagao
    • Organizer
      International Symposium on Computational Science 2017
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Langevin 動力学を用いたチラコイドルーメン内腔のプラストシアニンの拡散現象に関する理論的研究2017

    • Author(s)
      和田慎、高木晶平、中川聖、川口一朋、長尾秀実
    • Organizer
      第31 回分子シミュレーション討論会
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical Studies on Dynamics of Electron Carriers in Photosynthesis by a Coarse-grained Model2017

    • Author(s)
      Satoshi Nakagawa, Kazutomo Kawaguchi, Isman Kurniawan, Arwnsyah Saleh, Koichi Kodama, Hidemi Nagao
    • Organizer
      19th International Union for Pure and Applied Biophysics Congress, 11th European Biophysics Congress
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical Studies on Stability and Dynamics of Protein by a Coarse-grained Model2017

    • Author(s)
      Satoshi Nakagawa, Kazutomo Kawaguchi, Isman Kurniawan, Arwansyah Saleh, Koichi Kodama, Hidemi Nagao
    • Organizer
      XXIX IUPAP Conference on Computational Physics
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study on intermolecular interaction and structural stability of plastcyanin and cytochrom f complex by using Go-like model2017

    • Author(s)
      S. Nakagawa, S. Kinoshita, K. Kawaguchi, H. Nagao
    • Organizer
      The 57th Sanibel Symposium
    • Place of Presentation
      St. Simons Island, USA
    • Year and Date
      2017-02-19
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical Study of RA-VII as a Candidate for Anticancer Agent: Combination of Docking and Molecular Dynamics Simulation2017

    • Author(s)
      M.S. Arwansyah, I. Kurniawan, Y. Noguchi, K. Kawaguchi, T. Miyakawa, Y. Hitotsuyanagi, S. Yokojima, R. Morikawa, M. Takasu, and H. Nagao
    • Organizer
      International Symposium on Computational Science 2017
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study on the structural stability of vesicle consisting of mixed lipids by coarse-grained model2017

    • Author(s)
      Tetsu Matsuura, Shohei Takagi, Kazutomo Kawaguchi, Hidemi Nagao
    • Organizer
      第55回日本生物物理学会年会
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study of a coarse grained model of electrostatic interaction between protein molecules2017

    • Author(s)
      K. Kawaguchi, S. Nakagawa, I. Kurniawan, K. Kodama, M. Wada, H. Nagao
    • Organizer
      The 57th Sanibel Symposium
    • Place of Presentation
      St. Simons Island, USA
    • Year and Date
      2017-02-19
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical Study on Electronic Properties of the Active Site of Multicopper Protein2016

    • Author(s)
      I. Kurniawan, K. Kodama, M. Wada, S. Nakagawa, K. Sugimori, T. Sakurai, H. Nagao
    • Organizer
      第10回分子科学討論会
    • Place of Presentation
      神戸ファッションマート(神戸)
    • Year and Date
      2016-09-13
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] 疎水性アミノ酸残基間に働く有効相互作用に関する理論的研究2016

    • Author(s)
      川口一朋、齋藤大明、長尾秀実
    • Organizer
      日本物理学会第71回年次大会
    • Place of Presentation
      東北学院大学 仙台
    • Year and Date
      2016-03-19
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] 水溶液中のタンパク質間静電相互作用の粗視化モデル2016

    • Author(s)
      川口一朋、長尾秀実
    • Organizer
      第30回分子シミュレーション討論会
    • Place of Presentation
      大阪大学 基礎工学国際棟 シグマホール (大阪)
    • Year and Date
      2016-11-30
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical Study of a Coarse-grained Potential of Hydrophobic Interaction between Protein Molecules” (poster) International Symposium on Multi-scale Simulation of Condensed-phase Reacting Systems2016

    • Author(s)
      K. Kawaguchi, H. Nagao
    • Organizer
      MSCRS2016
    • Place of Presentation
      Nagoya, Japan
    • Year and Date
      2016-10-10
    • Int'l Joint Research
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study of a conformational change in Hsp902016

    • Author(s)
      K. Kawaguchi, H. Nagao
    • Organizer
      第54回日本生物物理学会年会
    • Place of Presentation
      つくば国際会議場(つくば)
    • Year and Date
      2016-11-25
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Hras-GTP/GDP系でのGTP/GDP周辺における水素結合の静的性質と動的性質の分子動力学法による研究2016

    • Author(s)
      宮川毅、森河良太、高須昌子、杉森公一、川口一朋、長尾秀実
    • Organizer
      日本物理学会2016年秋季大会
    • Place of Presentation
      金沢大学角間キャンパス(金沢)
    • Year and Date
      2016-09-13
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study on the process of the formation of lipid molecule cluster by coarse-grained model2016

    • Author(s)
      S. Kinoshita, S. Nakagawa, M. Wada, S. Ito, K. Kawaguchi, H. Nagao
    • Organizer
      第54回日本生物物理学会年会
    • Place of Presentation
      つくば国際会議場(つくば)
    • Year and Date
      2016-11-25
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] POPC の膜電位に関する理論的研究2016

    • Author(s)
      伊藤誠一朗、川口一朋、長尾秀実
    • Organizer
      第30回分子シミュレーション討論会
    • Place of Presentation
      大阪大学 基礎工学国際棟 シグマホール (大阪)
    • Year and Date
      2016-11-30
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] タンパク質間相互作用の粗視化モデルに関する理論的研究2016

    • Author(s)
      川口一朋、長尾秀実
    • Organizer
      第10回分子科学討論会
    • Place of Presentation
      神戸ファッションマート(神戸)
    • Year and Date
      2016-09-13
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study on the structural stability of plastocyanin and cytochrome f complex by using Go-like model2016

    • Author(s)
      S. Nakagawa, S. Kinoshita, M. Wada, K. Kawaguchi, H. Nagao
    • Organizer
      第54回日本生物物理学会年会
    • Place of Presentation
      つくば国際会議場(つくば)
    • Year and Date
      2016-11-25
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Analysis of dynamics of hydrogen bond between the solvent water and the Hras-GTP/GDP complexes by molecular dynamics simulations2016

    • Author(s)
      T. Miyakawa, R. Morikawa, M. Takasu, K. Sugimori, K. Kawaguchi, H. Nagao
    • Organizer
      第54回日本生物物理学会年会
    • Place of Presentation
      つくば国際会議場(つくば)
    • Year and Date
      2016-11-25
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical study of diffusion of plastocyanin with Langevin equation2016

    • Author(s)
      M. Wada, S. Nakagawa, S. Kinoshita, I. Kurniawan, K. Kodama, K. Kawaguchi, H. Nagao
    • Organizer
      第54回日本生物物理学会年会
    • Place of Presentation
      つくば国際会議場(つくば)
    • Year and Date
      2016-11-25
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Goモデルを用いたプラストシアニン―シトクロムfにおけるタンパク質間相互作用に関する理論的研究2015

    • Author(s)
      中川聖、木下翔吾、松井貴寛、川口一朋、齋藤大明、長尾秀実
    • Organizer
      第9回分子科学討論会
    • Place of Presentation
      東京工業大学 東京
    • Year and Date
      2015-09-16
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Role of water molecules for association of Hsp90 and ADP2015

    • Author(s)
      Kazutomo Kawaguchi, Hiroaki Saito, Hidemi Nagao
    • Organizer
      第53回日本生物物理学会年会
    • Place of Presentation
      金沢大学 金沢
    • Year and Date
      2015-09-13
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] 水溶液中の溶質分子の親水性・疎水性に関する理論的研究2015

    • Author(s)
      川口一朋、齋藤大明、長尾秀実
    • Organizer
      第9回分子科学討論会
    • Place of Presentation
      東京工業大学 東京
    • Year and Date
      2015-09-16
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] プラストシアニンとシトクロムfの会合―解離過程における自由エネルギー地形に関する理論的研究2015

    • Author(s)
      松井貴寛、中川聖、川口一朋、齋藤大明、長尾秀実
    • Organizer
      第9回分子科学討論会
    • Place of Presentation
      東京工業大学 東京
    • Year and Date
      2015-09-16
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Hras-GTP内におけるGTP周辺にある水分子の分子動力学法による研究2013

    • Author(s)
      宮川毅, 森河良太, 高須昌子, 杉森公一, 川口一朋, 齋藤大明, 長尾秀実
    • Organizer
      第68回 日本物理学会 春季大会
    • Place of Presentation
      広島
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Theoretical study of a pi-stacking interaction in carbonic anhydrase2013

    • Author(s)
      Muhamad Koyimatu, Hideto Shimahara, Kazutomo Kawaguchi, Hirosaki Saito, Hidemi Nagao
    • Organizer
      International Symposium on Computational Science 2013
    • Place of Presentation
      Kanazawa
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] Theoretical studies on oxidation of molecules by combining MD and QM/MM calculations2013

    • Author(s)
      Masashi Iwayama, Isman Kurniawan, Kazutomo Kawaguchi, Hiroaki Saito, Hidemi Nagao
    • Organizer
      The 53rd Sanibel Symposium
    • Place of Presentation
      Florida, USA
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Theoretical Study of a pi-stacking Interaction Effect to the Orientation of His64 of Carbonic Anhydrase2013

    • Author(s)
      Muhamad Koyimatu, Hideto Shimahara, Kimikazu Sugimori, Tetsuya Sugimori, Kazutomo Kawaguchi, Hiroaki Saito, Hidemi Nagao
    • Organizer
      第7回分子科学討論会
    • Place of Presentation
      京都,京都テルサ(京都府民総合交流プラザ)
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] Molecular dynamics analyses of dissociation process of ADP from Hsp902013

    • Author(s)
      K. Kawaguchi, H. Takagi, M. Iwayama, H. Saito, H. Nagao
    • Organizer
      International Symposium On Computational Science 2013(招待講演
    • Place of Presentation
      Kanazawa
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Π-stacking Interaction between Heterocyclic Rings in a Reaction Field of Biological System2013

    • Author(s)
      Muhamad KOYIMATU, Hideto SHIMAHARA, Kimikazu SUGIMORI, Kazutomo KAWAGUCHI, Hiroaki SAITO, and Hidemi NAGAO
    • Organizer
      The 12th Asia Pacific Physics Conference (APPC12)
    • Place of Presentation
      International Conference Halls, Makuhari Messe, Chiba
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] Molecular dynamics analyses of dissociation process of ADP from Hsp902013

    • Author(s)
      K. Kawaguchi, H. Takagi, M. Iwayama, H. Saito, H. Nagao
    • Organizer
      International Symposium On Computational Science 2013
    • Place of Presentation
      Kanazawa
    • Invited
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Molecular dynamics study of gramicidin A in lipid bilayer: structure and lateral pressure profile2012

    • Author(s)
      Hiroaki Saito, Masashi Iwayama, Hiroyuki Takagi,Kazutomo Kawaguchi, and Hidemi Nagao
    • Organizer
      The 5th International Symposium on Computational Sciences(ISCS) 2012(招待講演
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Theoretical Model for Assessing Properties of Local Structures in Metalloprotein2012

    • Author(s)
      M. Koyimatu, H. Shimahara, M. Iwayama, K. Sugimori, K. Kawaguchi, H. Saito, and H. Nagao
    • Organizer
      The 4th International Symposium on Slow Dynamics in Complex Systems
    • Place of Presentation
      Sendai
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] Binding Free Energy of Azurin-Cytochrome c551 Complex by all-atom Molecular Dynamics Simulation2012

    • Author(s)
      H. Saito, M. Iwayama, T. Mizukami, K. Kawaguchi, Hidemi Nagao
    • Organizer
      Conference on Computational Physics (CCP2012)
    • Place of Presentation
      Kobe
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Theoretical study on entrainment phenomenon in model molecular systems2012

    • Author(s)
      Hidemi Nagao, Michke Rusmerryani, Acep Pruqon, Kazutomo Kawaguchi, Hiroaki Saito
    • Organizer
      The 4th International Symposium on Slow Dynamics in Complex Systems
    • Place of Presentation
      Sendai
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Free energy profile for binding of ADP to Hsp90 with molecular dynamics simulation2012

    • Author(s)
      K. Kawaguchi, H. Takagi, M. Iwayama, M. Nishimura, H. Saito, Hidemi Nagao
    • Organizer
      第50回日本生物物理学会年会
    • Place of Presentation
      名古屋
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Free energy profile for binding of ADP to Hsp90 by molecular dynamics simulation2012

    • Author(s)
      Kazutomo Kawaguchi, Hiroyuki Takagi, Masashi Iwayama, Hiroaki Saito, and Hidemi Nagao
    • Organizer
      The 5th International Symposium on Computational Sciences (ISCS) 2012
    • Place of Presentation
      Yogyakarta, Indonesia
    • Invited
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Structure and lateral pressure profile of lipid bilayer containing gramicidin A by molecular dynamics simulation2012

    • Author(s)
      H. Saito, M. Iwayama, M. Nishimura, H. Takagi, K. Kawaguchi, H. Nagao
    • Organizer
      第50回日本生物物理学会年会
    • Place of Presentation
      名古屋
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] THEORETICAL STADIES ON SUPERCONDUCTIVITY IN ULTRASMALL GRAIN2012

    • Author(s)
      H.Nagao
    • Organizer
      9th International Conference on New Theories, Discoveries,and Applications of Superconductors and Related Materials
    • Place of Presentation
      Rome, Italy
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Binding Free Energy of Azurin-Cytochrome c551 Complex by all-atom Molecular DynamicsSimulation2012

    • Author(s)
      H. Saito, M. Iwayama, T. Mizukami, K.Kawaguchi, Hidemi Nagao
    • Organizer
      Conference on Computational Physics (CCP2012)
    • Place of Presentation
      Kobe
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Free energy profile for binding of ADP to Hsp90 by molecular dynamics simulation2012

    • Author(s)
      Kazutomo Kawaguchi, Hiroyuki Takagi, Masashi Iwayama, Hiroaki Saito, and Hidemi Nagao
    • Organizer
      The 5th International Symposium on Computational Sciences(ISCS) 2012(招待講演)
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Molecular dynamics study of gramicidin A in lipid bilayer: structure and lateral pressure profile2012

    • Author(s)
      Hiroaki Saito, Masashi Iwayama, Hiroyuki Takagi, Kazutomo Kawaguchi, and Hidemi Nagao
    • Organizer
      The 5th International Symposium on Computational Sciences (ISCS) 2012
    • Place of Presentation
      Yogyakarta, Indonesia
    • Invited
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] 溶液NMR法を用いた炭酸脱水酵素の亜鉛結合水のpKaの決定―H/D交換によるHis-溶媒接触の可能性―2012

    • Author(s)
      島原秀登,杉森公一,Koyimatu Muhamad,吉田卓也,長尾秀実,中澤隆,大久保忠恭,小林祐次
    • Organizer
      第12回蛋白質科学会年会
    • Place of Presentation
      名古屋
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] Theoretical study on entrainment phenomenon in model molecular systems2012

    • Author(s)
      Hidemi Nagao, Michke Rusmerryani, Acep Pruqon, Kazutomo Kawaguchi, Hiroaki Saito
    • Organizer
      The 4th International Symposium on Slow Dynamics in Complex Systems
    • Place of Presentation
      仙台
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Structure and lateral pressure profile of lipid bilayer containing gramicidin A by molecular dynamicssimulation2012

    • Author(s)
      H. Saito, M. Iwayama, M. Nishimura, H. Takagi,K. Kawaguchi, H. Nagao
    • Organizer
      第50回日本生物物理学会年会
    • Place of Presentation
      名古屋
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] An Approach to Water Molecule Dynamics Associated with Motion of Catalytic Moiety2012

    • Author(s)
      Hideto Shimahara, Kimikazu Sugimori, Muhmad Koyimatu, Hidemi Nagao, Tadayasu Ohkubo, and Yuji Kobayashi
    • Organizer
      The 4th International Symposium on Slow Dynamics in Complex Systems
    • Place of Presentation
      Sendai
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] Hydrogen-bonding Network and His64 in Carbonic Anhydrase,炭酸脱水酵素の水素結合ネットワークとHis62012

    • Author(s)
      Muhamad Koyimatu,島原秀登,杉森公一,岩山将士,杉森哲也,川口一朋,齊藤大明,吉田卓也,中沢隆,大久保忠恭,小林祐次,長尾秀実
    • Organizer
      第6回分子科学討論会
    • Place of Presentation
      東京
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] THEORETICAL STADIES ON SUPERCONDUCTIVITY IN ULTRASMALL GRAIN2012

    • Author(s)
      H.Nagao
    • Organizer
      9th International Conference on New Theories, Discoveries, and Applications of Superconductors and Related Materials
    • Place of Presentation
      Rome, Italy
    • Invited
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Free energy profile of Hsp90-ADP binding by molecular dynamics simulations2012

    • Author(s)
      K. Kawaguchi, H. Saito, Hidemi Nagao
    • Organizer
      Conference on Computational Physics (CCP2012)
    • Place of Presentation
      Kobe
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Binding free energy of oxidized Azurin - reduced Cytochrome c551 Complex2011

    • Author(s)
      Hiroaki Saito, Masashi Iwayama, Taku Mizukami, Hidemi Nagao
    • Organizer
      The Seventh Congress of the International Society for Theoretical Chemical Physics (ISTCP-VII)
    • Place of Presentation
      Waseda University (JAPAN)
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] タイプI銅タンパク質の酸化還元電位に関する理論的研究2009

    • Author(s)
      長尾秀実^1, 杉森公一^2, Phung Thi Viet Bac^1, 杉山歩^1, 齋藤大明^1, 西川清
    • Organizer
      分子科学討論会
    • Place of Presentation
      名古屋大学(愛知県)
    • Year and Date
      2009-09-23
    • Data Source
      KAKENHI-PROJECT-20038018
  • [Presentation] Structural Stability and Dynamics of Complex of Azurin and Cytochrome by Molecular Dynamics Simulation2008

    • Author(s)
      Hidemi Nagao
    • Organizer
      The 2^<nd> International Conference on Mathematics and Natural Science 2008
    • Place of Presentation
      Bandung, Indonesia
    • Year and Date
      2008-10-28
    • Data Source
      KAKENHI-PROJECT-20038018
  • [Presentation] Theoretical Studies on Docking Dynamics and Electronic Structure in Metalloprotein Complexes2007

    • Author(s)
      Hidemi Nagao
    • Organizer
      International Conference of Computational Methods in Science and Engineering
    • Place of Presentation
      Corfu, Greece
    • Year and Date
      2007-09-25
    • Data Source
      KAKENHI-PROJECT-19029014
  • [Presentation] Theoretical Studies on Stable Structure and Noncollinear Magnetism of Aluminum Clusters2007

    • Author(s)
      H. Nagao
    • Organizer
      ICCMSE 2007
    • Place of Presentation
      ギリシャ
    • Year and Date
      2007-09-29
    • Data Source
      KAKENHI-PROJECT-19350070
  • [Presentation] Theoretical Studies on Stable Structure and Noncollinear Magnetism of Aluminum Clusters2007

    • Author(s)
      長尾秀実
    • Organizer
      ICCMSE2007
    • Place of Presentation
      ホテルマルベラギリシャ
    • Year and Date
      2007-09-29
    • Data Source
      KAKENHI-PROJECT-19350070
  • [Presentation] フレキシブルモデルを用いた分子ドッキング法の開発

    • Author(s)
      齋藤大明,川口一朋,長尾秀実
    • Organizer
      第8回分子科学討論会
    • Place of Presentation
      東広島
    • Year and Date
      2014-09-21 – 2014-09-24
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] タンパク質間の解離過程における 自由エネルギー地形に関する理論的研究

    • Author(s)
      松井 貴寛, 齋藤 大明, 川口 一朋, 長尾 秀実
    • Organizer
      第8回分子科学討論会
    • Place of Presentation
      東広島
    • Year and Date
      2014-09-21 – 2014-09-24
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] 膜透過ペプチドによる脂質二重膜の4種類の変形

    • Author(s)
      川本周平, 高須昌子, 宮川毅, 森河良太, 小田竜樹, 齋藤大明, 二木史朗, 長尾秀実
    • Organizer
      物理学会秋年会
    • Place of Presentation
      富山大学(富山県)
    • Data Source
      KAKENHI-PROJECT-23655101
  • [Presentation] Theoretical study of distribution of ADP in binding pocket of Hsp90

    • Author(s)
      Kazutomo Kawaguchi, Hiroaki Saito, Hidemi Nagao
    • Organizer
      第52回日本生物物理学会年会
    • Place of Presentation
      札幌
    • Year and Date
      2014-09-25 – 2014-09-26
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] Theoretical Study of Tautomerization and Conformations of His64 in Human Carbonic Anhydrase II

    • Author(s)
      Koyimatu Muhamad,Shimahara Hideto,Sugimori Kimikazu,Saito Hiroaki,Kawaguchi Kazutomo,Nagao Hidemi
    • Organizer
      第8回分子科学討論会
    • Place of Presentation
      広島大学東広島キャンパス(広島県東広島市)
    • Year and Date
      2014-09-21 – 2014-09-24
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] 炭酸脱水酵素の触媒反応に見られるプロトン移動の解明に向けた実験・理論的アプローチ

    • Author(s)
      島原 秀登,ムハマド コイマツ,杉森 公一,齋藤 大明,川口 一朋,長尾 秀実
    • Organizer
      第8回分子科学討論会
    • Place of Presentation
      広島大学東広島キャンパス(広島県東広島市)
    • Year and Date
      2014-09-21 – 2014-09-24
    • Data Source
      KAKENHI-PROJECT-24550173
  • [Presentation] Hras-GTP の GTP 周辺での溶媒水と複合体の水素結合の分子動力学法による研究

    • Author(s)
      宮川毅, 森河良太, 高須昌子, 杉森公一, 川口一朋, 齋藤大明, 長尾秀実
    • Organizer
      日本物理学会2014年秋季大会
    • Place of Presentation
      中部大学
    • Year and Date
      2014-09-07 – 2014-09-11
    • Data Source
      KAKENHI-PROJECT-26400429
  • [Presentation] MD法とQM/MM計算によるブルー銅タンパク質の酸化還元電位に関する理論的研究

    • Author(s)
      岩山将士,齋藤大明,川口一朋,長尾秀実
    • Organizer
      第8回分子科学討論会
    • Place of Presentation
      東広島
    • Year and Date
      2014-09-21 – 2014-09-24
    • Data Source
      KAKENHI-PROJECT-26400429
  • 1.  山口 兆 (80029537)
    # of Collaborated Projects: 3 results
    # of Collaborated Products: 0 results
  • 2.  KONO Hirohiko (70178226)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 0 results
  • 3.  OKUMURA Mitsutaka (40356712)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 0 results
  • 4.  KAWAKAMI Takashi (30321748)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 0 results
  • 5.  KITAGAWA Yasutaka (60362612)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 0 results
  • 6.  YAMANAKA Syuusuke (10324865)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 0 results
  • 7.  SHIMAHARA Hideto (40313704)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 15 results
  • 8.  OHKUBO Tadayasu (90272997)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 5 results
  • 9.  KOBAYASHI Yuji (20127228)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 5 results
  • 10.  NAGAYAMA Masaharu (20314289)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 0 results
  • 11.  SAITO Hiroaki (40506820)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 48 results
  • 12.  KAWAGUCHI Kazutomo (90402429)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 60 results
  • 13.  SUGIMORI Kimikazu (40581632)
    # of Collaborated Projects: 2 results
    # of Collaborated Products: 10 results
  • 14.  NAGARA Hitose (10135676)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 2 results
  • 15.  GESHI Masaaki (70397660)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 2 results
  • 16.  ODA Tatsuki (30272941)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 4 results
  • 17.  KATO Tsuyoshi (10321986)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
  • 18.  YOSHIDA Takuya (00294116)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 1 results
  • 19.  NAKAZAWA Takashi (30175492)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 1 results
  • 20.  SAKIYAMA Fumio (40029947)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
  • 21.  MIZUKAMI Taku (50270955)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 3 results
  • 22.  MATSUSHITA Mitsugu (20091746)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
  • 23.  KITAHATA Hiroyuki (20378532)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
  • 24.  IWASAKI Hiroshi (30242514)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
  • 25.  FUJIMURA Yuichi (90004473)
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 0 results
  • 26.  NAKAGAWA Satoshi
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 20 results
  • 27.  KODAMA Koichi
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 9 results
  • 28.  Kurniawan Isman
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 14 results
  • 29.  Saleh Arwansyah
    # of Collaborated Projects: 1 results
    # of Collaborated Products: 5 results

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