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An Interactive Cluster Heat Map to Visualize and Explore Multidimensional Metabolomic Data

机译:交互式集群热图以可视化和探索多维代谢组学数据

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摘要

Heat maps are a commonly used visualization tool for metabolomic data where the relative abundance of ions detected in each sample is represented with color intensity. A limitation of applying heat maps to global metabolomic data, however, is the large number of ions that have to be displayed and the lack of information provided about important metabolomic parameters such as m/z and retention time. Here we address these challenges by introducing the interactive cluster heat map in the data-processing software XCMS Online. XCMS Online () is a cloud-based informatic platform designed to process, statistically evaluate, and visualize mass-spectrometry based metabolomic data. An interactive heat map is provided for all data processed by XCMS Online. The heat map is clickable, allowing users to zoom and explore specific metabolite metadata (EICs, Box-and-whisker plots, mass spectra) that are linked to the METLIN metabolite database. The utility of the XCMS interactive heat map is demonstrated on metabolomic data set generated from different anatomical regions of the mouse brain.
机译:热图是代谢组学数据的常用可视化工具,其中每个样品中检测到的离子的相对丰度用颜色强度表示。但是,将热图应用于全局代谢组学数据的局限性在于必须显示大量离子,并且缺少有关重要代谢组学参数(例如m / z和保留时间)的信息。在这里,我们通过在数据处理软件XCMS Online中引入交互式群集热图来应对这些挑战。 XCMS Online()是一个基于云的信息平台,旨在处理,统计评估和可视化基于质谱的代谢组学数据。为XCMS Online处理的所有数据提供了交互式热图。热图是可单击的,允许用户缩放和浏览链接到METLIN代谢物数据库的特定代谢物元数据(EIC,箱须图,质谱)。 XCMS交互式热图的实用性在从小鼠大脑不同解剖区域生成的代谢组学数据集上得到了证明。

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