Molecular level material design system based on fundamental IT technology
| Project/Area Number |
19700103
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| Research Category |
Grant-in-Aid for Young Scientists (B)
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| Allocation Type | Single-year Grants |
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| Research Field |
Media informatics/Database
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| Research Institution | Kanazawa Institute of Technology |
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Principal Investigator |
HAYASHI Ryoko Kanazawa Institute of Technology, 情報学部, 講師 (30303332)
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| Project Period (FY) |
2007 – 2009
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| Project Status |
Completed (Fiscal Year 2009)
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| Budget Amount *help |
¥3,800,000 (Direct Cost: ¥3,200,000、Indirect Cost: ¥600,000)
Fiscal Year 2009: ¥1,040,000 (Direct Cost: ¥800,000、Indirect Cost: ¥240,000)
Fiscal Year 2008: ¥1,560,000 (Direct Cost: ¥1,200,000、Indirect Cost: ¥360,000)
Fiscal Year 2007: ¥1,200,000 (Direct Cost: ¥1,200,000)
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| Keywords | 情報システム / 材料設計 / シミュレーション / モデル化 / タンパク質 / 免疫物質 / ナノテクノロジー / 高性能計算 / データ処理 / 可視化 / GA |
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| Research Abstract |
In the first year, I developed a prototype system for computational material design and executed fundamental performance evaluation about job scheduling. The prototype system uses master-slave model and one of the simple job scheduling method is master distribution of the jobs among slaves. The method may cause bottleneck so that I examined the performance. As the result of the performance evaluation, I realized the method would not cause bottleneck for the material design simulations. In the second and third years, I studied scFv capacitance evaluation simulation. As the result, simplified model for scFv molecules are realized so that preparation for scFv chip level simulation. The future work will be about exhaustive simulations for scFv capacitance evaluation on the material design system.
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Report
(4 results)
Research Products
(8 results)
