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Molecular Dynamics Studies on Structure and Dynamics of Spherical Micelles
https://doi.org/10.24517/00011994
https://doi.org/10.24517/000119947f8ad9fb-1252-41d5-85a7-6f5e6eeda43c
| 名前 / ファイル | ライセンス | アクション |
|---|---|---|
ISCS2011Proceedings-59-68.pdf (1.3 MB)
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| Item type | 報告書 / Research Paper(1) | |||||
|---|---|---|---|---|---|---|
| 公開日 | 2017-10-03 | |||||
| タイトル | ||||||
| タイトル | Molecular Dynamics Studies on Structure and Dynamics of Spherical Micelles | |||||
| 言語 | ||||||
| 言語 | eng | |||||
| 資源タイプ | ||||||
| 資源タイプ識別子 | http://purl.org/coar/resource_type/c_18ws | |||||
| 資源タイプ | research report | |||||
| ID登録 | ||||||
| ID登録 | 10.24517/00011994 | |||||
| ID登録タイプ | JaLC | |||||
| 著者 |
Micke, Rusmerryani
× Micke, Rusmerryani× Gia, Septiana× Kawamoto, Shuhei× Saito, Hiroaki× Nishikawa, Kiyoshi× Nagao, Hidemi |
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| 書誌情報 |
Recent development in computational science : Selected Papers from the International Symposium on Computational Science - International Symposium on Computational Science Kanazawa University, Japan 巻 2, p. 59-68, 発行日 2011-10-01 |
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| ISSN | ||||||
| 収録物識別子タイプ | ISSN | |||||
| 収録物識別子 | 2223-0785 | |||||
| 出版者 | ||||||
| 出版者 | Kanazawa e-Publishing | |||||
| 抄録 | ||||||
| 内容記述タイプ | Abstract | |||||
| 内容記述 | Due to the soft and flexible structure, lipid molecule forms various shapes such as micelle, bilayer and vesicle. In these systems, since the spherical micelle can be applied to the application of drag delivery system, the analysis of detailed structure and dynamics of the micelle is important. In this study, we carried out molecular dynamics (MD) simulations of the spherical micelles dimer in water solvent to investigate the dynamical structure and correlated motion of the micelle dimer. The MD simulations were run under the constant NPT and NVT conditions with periodic boundary. We adopted the ASIC analysis, which is based on the aperture, symme-try, isotropy, and compactness of the micelle structure to analyze the shape fluctuations for each micelle. From this analysis, we show the stability and correlated motion of spherical micelle and investigate the patterns of synchronization motions between micelle dimer. The mutual fluctuations were periodically shown in the constant NVT simulation, implying that the existence of synchro-nization phenomena between micelle dimer. | |||||
| 権利 | ||||||
| 権利情報 | Organizing Committee of ISCS | |||||
| 著者版フラグ | ||||||
| 出版タイプ | VoR | |||||
| 出版タイプResource | http://purl.org/coar/version/c_970fb48d4fbd8a85 | |||||
