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MetaQuant: a tool for the automatic quantification of GC/MS-based metabolome data

机译:MetaQuant:用于自动定量基于GC / MS的代谢组数据的工具

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摘要

MetaQuant is a Java-based program for the automatic and accurate quantification of GC/MS-based metabolome data. In contrast to other programs MetaQuant is able to quantify hundreds of substances simultaneously with minimal manual intervention. The integration of a self-acting calibration function allows the parallel and fast calibration for several metabolites simultaneously. Finally, MetaQuant is able to import GC/MS data in the common NetCDF format and to export the results of the quantification into Systems Biology Markup Language (SBML), Comma Separated Values (CSV) or Microsoft Excel (XLS) format.
机译:MetaQuant是基于Java的程序,用于自动,准确地定量基于GC / MS的代谢组数据。与其他程序相比,MetaQuant能够以最少的人工干预同时量化数百种物质。自作用校准功能的集成允许同时对多种代谢物进行平行和快速校准。最后,MetaQuant能够以通用NetCDF格式导入GC / MS数据,并将定量结果导出为系统生物学标记语言(SBML),逗号分隔值(CSV)或Microsoft Excel(XLS)格式。

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