| Budget Amount *help |
¥2,535,000 (Direct Cost: ¥1,950,000、Indirect Cost: ¥585,000)
Fiscal Year 2009: ¥1,170,000 (Direct Cost: ¥900,000、Indirect Cost: ¥270,000)
Fiscal Year 2008: ¥1,365,000 (Direct Cost: ¥1,050,000、Indirect Cost: ¥315,000)
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| Research Abstract |
To improve accuracy of virtual screening in which candidate medical compounds were searched fast by computer, COMBINE method that is one of the Quantitative Structure-Activity Relationship (QSAR) was applied as the scoring function. As the results of several validations, active compounds were able to be extracted at high throughput. Furthermore, binding mode of the compounds to their target protein could be predicted at the same time.
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