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Heterogeneous Database Federation Using Grid Technology for Drug Discovery Process

机译:异构数据库联合使用网格技术进行药物发现过程

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The rapid progress of biotechnology provides an increasing number of life science databases. These databases have been operated and managed individually on the Internet. Under such a circumstance, it is needed to develop an infrastructure that allows to share information contained in these databases and to conduct research collaboration. Grid technology is an emerging technology for seamless and loose integration of diverse resources distributed on the Internet. In order to achieve federation of the heterogeneous databases, we have developed a system for supporting a drug discovery process using Globus Toolkit3/OGSA-DAI. As an essential part of the system, we introduce a protein-compound interaction search based on a meta-data bridging protein and compound information with their interaction types; such as, inhibitor, agonist, antagonist, etc. The effectiveness of our system is demonstrated by searching for the candidate compounds interacting with the glucocorticoid receptor protein.
机译:生物技术的快速进步提供了越来越多的生命科学数据库。这些数据库已在Internet上单独操作和管理。在这种情况下,需要开发一个基础设施,允许共享这些数据库中包含的信息并进行研究合作。网格技术是一种新兴技术,可实现在互联网上分布的各种资源的无缝和宽松集成。为了实现异构数据库联合,我们开发了一种使用Globus Toolkit3 / Ogsa-Dai支持药物发现过程的系统。作为该系统的重要组成部分,我们基于Meta-Data桥接蛋白和复合信息引入蛋白质复合相互作用搜索,以及它们的相互作用类型;如,抑制剂,激动剂,拮抗剂等通过搜索与糖皮质激素受体蛋白相互作用的候选化合物来证明我们的系统的有效性。

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