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HMDB: a knowledgebase for the human metabolome.

机译:HMDB:人类代谢组学的知识库。

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The Human Metabolome Database (HMDB, http://www.hmdb.ca) is a richly annotated resource that is designed to address the broad needs of biochemists, clinical chemists, physicians, medical geneticists, nutritionists and members of the metabolomics community. Since its first release in 2007, the HMDB has been used to facilitate the research for nearly 100 published studies in metabolomics, clinical biochemistry and systems biology. The most recent release of HMDB (version 2.0) has been significantly expanded and enhanced over the previous release (version 1.0). In particular, the number of fully annotated metabolite entries has grown from 2180 to more than 6800 (a 300% increase), while the number of metabolites with biofluid or tissue concentration data has grown by a factor of five (from 883 to 4413). Similarly, the number of purified compounds with reference to NMR, LC-MS and GC-MS spectra has more than doubled (from 380 to more than 790 compounds). In addition to this significant expansion in database size, many new database searching tools and new data content has been added or enhanced. These include better algorithms for spectral searching and matching, more powerful chemical substructure searches, faster text searching software, as well as dedicated pathway searching tools and customized, clickable metabolic maps. Changes to the user-interface have also been implemented to accommodate future expansion and to make database navigation much easier. These improvements should make the HMDB much more useful to a much wider community of users.
机译:人类代谢组数据库(HMDB,http://www.hmdb.ca)是一个注释丰富的资源,旨在满足生物化学家,临床化学家,医师,医学遗传学家,营养学家和代谢组学界的广泛需求。自2007年首次发布以来,HMDB已被用于促进代谢组学,临床生物化学和系统生物学方面近100篇已发表研究的研究。 HMDB的最新版本(2.0版)已比以前的版本(1.0版)进行了显着扩展和增强。特别是,完全注释的代谢物条目的数量已从2180增加到超过6800(增加了300%),而具有生物流体或组织浓度数据的代谢物的数量增长了五倍(从883到4413)。同样,相对于NMR,LC-MS和GC-MS光谱,纯化的化合物数量增加了一倍以上(从380种增加至790多种化合物)。除了数据库大小的显着扩展之外,还添加或增强了许多新的数据库搜索工具和新的数据内容。这些工具包括用于光谱搜索和匹配的更好算法,更强大的化学子结构搜索,更快的文本搜索软件,以及专用的途径搜索工具和可定制的可点击代谢图。还已经对用户界面进行了更改,以适应将来的扩展并使数据库导航更加容易。这些改进将使HMDB对更广泛的用户社区更加有用。

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