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Molecular fluid simulation for self-organized/self-assembled pattern formation by applying group theory

Research Project

Project/Area Number 24656126
Research Category

Grant-in-Aid for Challenging Exploratory Research

Allocation TypeSingle-year Grants
Research Field Fluid engineering
Research InstitutionOsaka University

Principal Investigator

KAWANO Satoyuki  大阪大学, 基礎工学研究科, 教授 (00250837)

Co-Investigator(Kenkyū-buntansha) DOI Kentaro  大阪大学, 基礎工学研究科, 准教授 (20378798)
Project Period (FY) 2012-04-01 – 2014-03-31
Project Status Completed (Fiscal Year 2013)
Budget Amount *help
¥4,030,000 (Direct Cost: ¥3,100,000、Indirect Cost: ¥930,000)
Fiscal Year 2013: ¥910,000 (Direct Cost: ¥700,000、Indirect Cost: ¥210,000)
Fiscal Year 2012: ¥3,120,000 (Direct Cost: ¥2,400,000、Indirect Cost: ¥720,000)
Keywords分子流体力学 / 自己組織化 / 自己集合化 / 対称性 / 群論 / 分子流動シミュレーション
Research Abstract

To clarify a pattern formation mechanism resulting from self-organization or self-assembly of molecules, we have performed experimental observations, theoretical developments, and molecular dynamics simulations. We successfully visualized self-assembled patterns of DNA fragments on mica and highly oriented pyrolytic graphite surfaces by atomic force microscopy. In addition to a coarse-grained molecular dynamics simulation, a reaction-diffusion model is applied to represent slow growths of the self-assembled patterns, in which symmetries of surfaces can be implemented by symmetric functions resulting from irreducible representations of group theory. Consequently, various self-assembled patterns which depend on surface conditions could be simulated in the practical temporal and spatial scales in comparison with experiments. Some parameters sensitive to the surface conditions were found out.

Report

(3 results)
  • 2013 Annual Research Report   Final Research Report ( PDF )
  • 2012 Research-status Report
  • Research Products

    (48 results)

All 2014 2013 2012 Other

All Journal Article (8 results) (of which Peer Reviewed: 6 results) Presentation (30 results) Remarks (7 results) Patent(Industrial Property Rights) (3 results)

  • [Journal Article] Reaction-Diffusion Wave Model for Self-Assembled Network Formation of Poly(dA)・Poly(dT) DNA on Mica and HOPG Surfaces2014

    • Author(s)
      Kentaro Doi, Yukihiro Toyokita, Shingo Akamatsu, and Satoyuki Kawano
    • Journal Title

      Computer Methods in Biomechanics and Biomedical Engineering

      Volume: 17 Pages: 661-677

    • Related Report
      2013 Final Research Report
  • [Journal Article] Self-Assembly of 50 bp Poly(dA)・Poly(dT) DNA on Highly Oriented Pyrolytic Graphite via Atomic Force Microscopy Observation and Molecular Dynamics Simulation2013

    • Author(s)
      Kentaro Doi, Hiroshi Takeuchi, Ryosuke Nii, Shingo Akamatsu, Toshiya Kakizaki, and Satoyuki Kawano
    • Journal Title

      The Journal of Chemical Physics

      Volume: 139

    • Related Report
      2013 Final Research Report
  • [Journal Article] Self-Assembly of 50 bp poly(dA)・poly(dT) DNA on Highly Oriented Pyrolytic Graphite via Atomic Force Microscopy Observation and Molecular Dynamics Simulation2013

    • Author(s)
      Kentaro DOI, Hiroshi TAKEUCHI, Ryosuke NII, Shingo AKAMATSU, Toshiya KAKIZAKI, and Satoyuki KAWANO
    • Journal Title

      The Journal of Chemical Physics

      Volume: 139 Issue: 8

    • DOI

      10.1063/1.4818595

    • Related Report
      2013 Annual Research Report
    • Peer Reviewed
  • [Journal Article] Development of a Microfabricated Device for Low-Voltage Electropermeabilization of Adherent Cells2013

    • Author(s)
      Kazumi HAKAMADA, Hirofumi SHINTAKU, Takeshi NAGATA, Hiroshi FUJIMOTO, Satoyuki KAWANO, and Jun MIYAKE
    • Journal Title

      Journal of Bioscience and Bioengineering

      Volume: 115 Issue: 3 Pages: 314-319

    • DOI

      10.1016/j.jbiosc.2012.10.005

    • NAID

      110009596107

    • Related Report
      2012 Research-status Report
    • Peer Reviewed
  • [Journal Article] Development of Micro-Vibrating Flow Pumps using MEMS Technologies2012

    • Author(s)
      Osman Omran OSMAN, Hirofumi SHINTAKU, and Satoyuki KAWANO
    • Journal Title

      Microfluidics and Nanofluidics

      Volume: 13 Issue: 5 Pages: 703-713

    • DOI

      10.1007/s10404-012-0988-5

    • Related Report
      2012 Research-status Report
    • Peer Reviewed
  • [Journal Article] Dissociative Adsorption of H2 Molecules on Steric Graphene Surface: Ab Initio MD Study based on DFT2012

    • Author(s)
      Kentaro DOI, Ikumi ONISHI, and Satoyuki KAWANO
    • Journal Title

      Computational and Theoretical Chemistry

      Volume: 994 Pages: 54-64

    • DOI

      10.1016/j.comptc.2012.06.013

    • Related Report
      2012 Research-status Report
    • Peer Reviewed
  • [Journal Article] Reaction-Diffusion Wave Model for Self-Assembled Network Formation of Poly(dA)・Poly(dT) DNA on Mica and HOPG Surfaces2012

    • Author(s)
      Kentaro DOI, Yukihiro TOYOKITA, Shingo AKAMATSU, and Satoyuki KAWANO
    • Journal Title

      Computer Methods in Biomechanics and Biomedical Engineering

      Volume: iFirst article Issue: 6 Pages: 1-17

    • DOI

      10.1080/10255842.2012.723701

    • Related Report
      2012 Research-status Report
    • Peer Reviewed
  • [Journal Article] Theoretical Study of Electric Current in DNA Base Molecules Trapped between Nanogap Electrodes2012

    • Author(s)
      Kentaro DOI, Yuki NISHIOKA, and Satoyuki KAWANO
    • Journal Title

      Computational and Theoretical Chemistry

      Volume: 999 Pages: 203-214

    • DOI

      10.1016/j.comptc.2012.08.039

    • Related Report
      2012 Research-status Report
    • Peer Reviewed
  • [Presentation] 対称性を有する表面におけるパターン形成の反応拡散モデル2014

    • Author(s)
      土井謙太郎,新居良介,川野聡恭
    • Organizer
      日本機械学会関西支部第89期定時総会講演会
    • Place of Presentation
      大阪府立大学中百舌鳥キャンパス
    • Related Report
      2013 Annual Research Report 2013 Final Research Report
  • [Presentation] Dynamics and Self-Assembled Pattern Formation of Short DNA Fragments2013

    • Author(s)
      Kentaro Doi, Ryosuke Nii, Hiroshi Takeuchi, and Satoyuki Kawano
    • Organizer
      Tenth International Conference on Flow Dynamics
    • Place of Presentation
      Sendai, Japan
    • Related Report
      2013 Annual Research Report 2013 Final Research Report
  • [Presentation] Fractal Dimension of Self-Assembled 50 bp Poly(dA)・Poly(dT) DNA on HOPG Surface2013

    • Author(s)
      Ryosuke Nii, Hiroshi Takeuchi, Kentaro Doi, and Satoyuki Kawano
    • Organizer
      The 15^<th> International Conference on Biomedical Engineering
    • Place of Presentation
      National University Singapore, Singapore
    • Related Report
      2013 Final Research Report
  • [Presentation] Langevin Dynamics Simulation of Single-Stranded DNA Translocation through Nanopore in External Non-Uniform Electric Field2013

    • Author(s)
      Weixin Qian, Kentaro Doi, and Satoyuki Kawano
    • Organizer
      The 15^<th> International Conference on Biomedical Engineering
    • Place of Presentation
      National University Singapore, Singapore
    • Related Report
      2013 Final Research Report
  • [Presentation] ナノ流路におけるDNAの電気泳動に関する粗視化分子動力学解析2013

    • Author(s)
      銭偉欣,森田介斗,土井謙太郎,川野聡恭
    • Organizer
      日本機械学会2013年度年次大会
    • Place of Presentation
      岡山大学津島キャンパス
    • Related Report
      2013 Annual Research Report 2013 Final Research Report
  • [Presentation] Poly(dA)・Poly(dT)DNA断片による自己集合化ネットワーク形成のダイナミクス2013

    • Author(s)
      土井謙太郎,新居良介,竹内博,松岡理人,川野聡恭
    • Organizer
      日本機械学会第91期流体工学部門講演会
    • Place of Presentation
      九州大学伊都キャンパス
    • Related Report
      2013 Final Research Report
  • [Presentation] Fractal Dimension of Self-Assembled 50 bp Poly(dA)・Poly(dT) DNA on HOPG Surface2013

    • Author(s)
      Ryosuke NII, Hiroshi TAKEUCHI, Kentaro DOI, and Satoyuki KAWANO
    • Organizer
      The 15th International Conference on Biomedical Engineering
    • Place of Presentation
      National University of Singapore, Singapore
    • Related Report
      2013 Annual Research Report
  • [Presentation] Langevin Dynamics Simulation of Single-Stranded DNA Translocation though Nanopore in External Non-Uniform Electric Field2013

    • Author(s)
      Weixin QIAN, Kentaro DOI, and Satoyuki KAWANO
    • Organizer
      The 15th International Conference on Biomedical Engineering
    • Place of Presentation
      National University of Singapore, Singapore
    • Related Report
      2013 Annual Research Report
  • [Presentation] Poly(dA)・Poly(dT)DNA断片による自己集合化ネットワーク形成のダイナミクス2013

    • Author(s)
      土井謙太郎,新居良介,竹内博,松岡理人,川野聡恭
    • Organizer
      日本機械学会 第91期 流体工学部門講演会
    • Place of Presentation
      九州大学伊都キャンパス
    • Related Report
      2013 Annual Research Report
  • [Presentation] Application of Reaction-Diffusion Wave to Self-Assembled Network Structures of DNA2012

    • Author(s)
      Kentaro Doi, Yukihiro Toyokita, and Satoyuki Kawano
    • Organizer
      The Proceedings of the 10^<th> International Symposium on Computer Methods in Biomechanics and Biomedical Engineering
    • Place of Presentation
      Berlin, Germany
    • Related Report
      2013 Final Research Report
  • [Presentation] Molecular Dynamics Simulations for DNA Deformations Affected by Nanopillars with Applied Electric Voltages2012

    • Author(s)
      Kaito Morita, Kentaro Doi, Sakon Rahong, Takeshi Yanagida, Tomoji Kawai, and Satoyuki Kawano
    • Organizer
      The Proceedings of the 10^<th> International Symposium on Computer Methods in Biomechanics and Biomedical Engineering
    • Place of Presentation
      Berlin, Germany
    • Related Report
      2013 Final Research Report
  • [Presentation] Coarse-Grained Molecular Dynamics Simulations of Self-Assembled DNA on HOPG surfaces2012

    • Author(s)
      Hiroshi Takeuchi, Ryosuke Nii, Kentaro Doi, and Satoyuki Kawano
    • Organizer
      The Proceedings of the 10^<th> International Symposium on Computer Methods in Biomechanics and Biomedical Engineering
    • Place of Presentation
      Berlin, Germany
    • Related Report
      2013 Final Research Report
  • [Presentation] せん断力を受ける鎖状生体高分子の流動モデル2012

    • Author(s)
      上原聡司,土井謙太郎,川野聡恭
    • Organizer
      日本機械学会2012年度年次大会
    • Place of Presentation
      金沢大学角間キャンパス
    • Related Report
      2013 Final Research Report 2012 Research-status Report
  • [Presentation] 陽イオンに覆われたHOPG基板上でのDNA自己集合化に関する分子動力学解析2012

    • Author(s)
      新居良介,竹内博,土井謙太郎,川野聡恭
    • Organizer
      日本機械学会2012年度年次大会
    • Place of Presentation
      金沢大学角間キャンパス
    • Related Report
      2013 Final Research Report 2012 Research-status Report
  • [Presentation] 壁面近傍における単鎖DNA拡散現象の一分子イメージング2012

    • Author(s)
      上原聡司,川野聡恭
    • Organizer
      日本機械学会第4回マイクロ・ナノ工学シンポジウム
    • Place of Presentation
      北九州国際会議場
    • Related Report
      2013 Final Research Report
  • [Presentation] Application of Reaction-Diffusion Wave to Self-Assembled Network Structures of DNA2012

    • Author(s)
      Kentaro DOI, Yukihiro TOYOKITA, and Satoyuki KAWANO
    • Organizer
      The Proceedings of the 10th International Symposium on Computer Methods in Biomechanics and Biomedical Engineering
    • Place of Presentation
      Berlin, Germany
    • Related Report
      2012 Research-status Report
  • [Presentation] Molecular Dynamics Simulations for DNA Deformations Affected by Nanopillars with Applied Electric Voltages2012

    • Author(s)
      Kaito MORITA, Kentaro DOI, Sakon RAHONG, Takeshi YANAGIDA, Tomoji KAWAI, and Satoyuki KAWANO
    • Organizer
      The Proceedings of the 10th International Symposium on Computer Methods in Biomechanics and Biomedical Engineering
    • Place of Presentation
      Berlin, Germany
    • Related Report
      2012 Research-status Report
  • [Presentation] Coarse-Grained Molecular Dynamics Simulations of Self-Assembled DNA Structures on HOPG surfaces2012

    • Author(s)
      Hiroshi TAKEUCHI, Ryosuke NII, Kentaro DOI, and Satoyuki KAWANO
    • Organizer
      The Proceedings of the 10th International Symposium on Computer Methods in Biomechanics and Biomedical Engineering
    • Place of Presentation
      Berlin, Germany
    • Related Report
      2012 Research-status Report
  • [Presentation] Development of Acoustic Resonator with Non-Uniform Thickness and Mechanical Property for Wide Frequency Range2012

    • Author(s)
      Takayuki KOBAYASHI, Kazuki ZUSHO, Hirofumi SHINTAKU, and Satoyuki KAWANO
    • Organizer
      2012 ASME-ISPS/JSME-IIP Joint International Conference on Micromechatronics for Information and Precision Equipment
    • Place of Presentation
      Santa Clara, California, USA
    • Related Report
      2012 Research-status Report
  • [Presentation] リチウムイオンと極性溶媒分子の相互作用に関する粗視化モデルの構築および評価2012

    • Author(s)
      西山裕太,土井謙太郎,川野聡恭
    • Organizer
      日本機械学会2012年度年次大会
    • Place of Presentation
      金沢大学角間キャンパス
    • Related Report
      2012 Research-status Report
  • [Presentation] ゲーティングナノポアデバイスによる単一バイオ分子の電気検出法の開発2012

    • Author(s)
      佐々木優太,大城敬人,川野聡恭,谷口正輝,川合知二
    • Organizer
      応用物理学会2012年秋季第73回応用物理学会学術講演会
    • Place of Presentation
      愛媛大学・松山大学
    • Related Report
      2012 Research-status Report
  • [Presentation] 壁面近傍における単鎖DNA拡散現象の一分子イメージング2012

    • Author(s)
      上原聡司,川野聡恭
    • Organizer
      日本機械学会 第4回マイクロ・ナノ工学シンポジウム
    • Place of Presentation
      北九州国際会議場
    • Related Report
      2012 Research-status Report
  • [Presentation] せん断流れ環境下で脂質二分子膜が示すマルチスケール構造不安定現象2012

    • Author(s)
      花崎逸雄,川野聡恭
    • Organizer
      日本機械学会 第4回マイクロ・ナノ工学シンポジウム
    • Place of Presentation
      北九州国際会議場
    • Related Report
      2012 Research-status Report
  • [Presentation] Development of Gating Nanopore towards Single-Bio-Molecule Electrical Identification2012

    • Author(s)
      Yuta SASAKI, Satoyuki KAWANO, Masateru TANIGUCHI, and Tomoji KAWAI
    • Organizer
      Micro TAS OKINAWA 2012
    • Place of Presentation
      沖縄コンベンションセンター
    • Related Report
      2012 Research-status Report
  • [Presentation] 流体中における生体分子の空間的拘束に関する分子動力学解析

    • Author(s)
      竹内宏和,花崎逸雄,川野聡恭
    • Organizer
      関西学生会 学生員卒業研究発表講演会
    • Place of Presentation
      大阪工業大学大宮キャンパス
    • Related Report
      2012 Research-status Report
  • [Presentation] ナノ細孔を通過するイオンのサイズ効果に関する分子動力学解析

    • Author(s)
      葛谷佳広,花崎逸雄,川野聡恭
    • Organizer
      関西学生会 学生員卒業研究発表講演会
    • Place of Presentation
      大阪工業大学大宮キャンパス
    • Related Report
      2012 Research-status Report
  • [Presentation] 生体分子のせん断流れ場に対する応答の分子動力学解析

    • Author(s)
      園部蒼馬,花崎逸雄,川野聡恭
    • Organizer
      関西学生会 学生員卒業研究発表講演会
    • Place of Presentation
      大阪工業大学大宮キャンパス
    • Related Report
      2012 Research-status Report
  • [Presentation] 流体中における生体分子の電気的拘束に関する分子動力学解析

    • Author(s)
      阪口季望矢,花崎逸雄,川野聡恭
    • Organizer
      関西学生会 学生員卒業研究発表講演会
    • Place of Presentation
      大阪工業大学大宮キャンパス
    • Related Report
      2012 Research-status Report
  • [Presentation] 生体分子の拡散係数と分子種の影響に関する分子動力学解析

    • Author(s)
      橋田陽介,花崎逸雄,川野聡恭
    • Organizer
      関西学生会 学生員卒業研究発表講演会
    • Place of Presentation
      大阪工業大学大宮キャンパス
    • Related Report
      2012 Research-status Report
  • [Presentation] 水溶液中のマイクロポアを介したイオン輸送の観察と理論解析

    • Author(s)
      深澤俊輔,土井謙太郎,川野聡恭
    • Organizer
      関西学生会 学生員卒業研究発表講演会
    • Place of Presentation
      大阪工業大学大宮キャンパス
    • Related Report
      2012 Research-status Report
  • [Remarks]

    • URL

      http://bnf.me.es.osaka-u.ac.jp

    • Related Report
      2013 Final Research Report
  • [Remarks] 大阪大学基礎工学研究科川野研究室

    • URL

      http://bnf.me.es.osaka-u.ac.jp/

    • Related Report
      2013 Annual Research Report
  • [Remarks] 大阪大学研究者総覧/川野聡恭

    • URL

      http://www.dma.jim.osaka-u.ac.jp/view?l=ja&u=5013

    • Related Report
      2013 Annual Research Report
  • [Remarks] 大阪大学研究者総覧/土井謙太郎

    • URL

      http://www.dma.jim.osaka-u.ac.jp/view?l=ja&u=6476

    • Related Report
      2013 Annual Research Report
  • [Remarks] 大阪大学基礎工学研究科川野研究室

    • URL

      http://bnf.me.es.osaka-u.ac.jp/

    • Related Report
      2012 Research-status Report
  • [Remarks] 大阪大学研究者総覧/川野聡恭

    • URL

      http://www.dma.jim.osaka-u.ac.jp/view?l=ja&u=5013

    • Related Report
      2012 Research-status Report
  • [Remarks] 大阪大学研究者総覧/土井謙太郎

    • URL

      http://www.dma.jim.osaka-u.ac.jp/view?l=ja&u=6476

    • Related Report
      2012 Research-status Report
  • [Patent(Industrial Property Rights)] 試料の固定化方法2012

    • Inventor(s)
      川野聡恭、土井謙太郎、新居良介、川合知二
    • Industrial Property Rights Holder
      大阪大学
    • Industrial Property Rights Type
      特許
    • Industrial Property Number
      2012-193566
    • Filing Date
      2012-09-03
    • Related Report
      2012 Research-status Report
  • [Patent(Industrial Property Rights)] 高分子の伸長方法および高分子伸長装置2012

    • Inventor(s)
      川野聡恭、新宅博文、雪本直哉、上原聡司、谷口正輝、川合知二
    • Industrial Property Rights Holder
      大阪大学
    • Industrial Property Rights Type
      特許
    • Industrial Property Number
      2012-218223
    • Filing Date
      2012-09-28
    • Related Report
      2012 Research-status Report
  • [Patent(Industrial Property Rights)] ポンプおよび送液方法2012

    • Inventor(s)
      川野聡恭、新宅博文、モサ オスマン オムラン オスマン、平田基徳
    • Industrial Property Rights Holder
      大阪大学
    • Industrial Property Rights Type
      特許
    • Industrial Property Number
      2012-247910
    • Filing Date
      2012-11-09
    • Related Report
      2012 Research-status Report

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Published: 2013-05-31   Modified: 2019-07-29  

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