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Increasing the Efficiency of Biomolecular Simulations

Increasing the Efficiency of Biomolecular Simulations
提高生物分子模拟的效率
批准号:
LX0882184
负责人:
Prof Alan Mark
金额:
$2.2万
依托单位国家:
澳大利亚
项目类别:
Linkage - International
财政年份:
2008
资助国家:
澳大利亚
项目状态:
已结题
起止时间:
2008-01-01 至 2011-04-30

项目摘要

项目成果

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中文摘要
翻译
该计划将扩大生物分子系统的范围,可以模拟近原子精度。 它将提供一个更好的理解的结构和功能的蛋白质参与调节膜融合和分裂,以及大规模的蛋白质-蛋白质和蛋白质-膜复合物的组装一般的光。这项工作将有助于澳大利亚在开发生物分子系统模拟技术方面处于最前沿,这些技术广泛应用于化学和制药行业。它还将为澳大利亚年轻研究人员的培训和发展提供机会。
英文摘要
This program will extend the range of biomolecular systems that can be modelled with near atomistic precision. It will provide a better understanding of the structure and function of proteins involved in the regulation of membrane fusion and fission as well as shedding light on the assembly of large-scale protein-protein and protein-membrane complexes in general. The work will help place Australia at the forefront of developing simulation techniques in biomolecular systems, which are widely used within the chemical and pharmaceutical industries. It will also provide opportunities for the training and development of young Australian researchers with top European laboratories.
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Enhanced force fields for computational drug design and materials research.
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Improving empirical force fields: a big-data approach.
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  • 财政年份:
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Understanding biological membranes in atomic detail
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  • 资助金额:
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  • 财政年份:
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  • 负责人:
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  • 依托单位:
海外基金