CE-TOFMS data from a urine sample - mzML files with scans in profile or centroid spectrum format

Those datasets are characteristics of urine samples separated by capillary electrophoresis hyphenated with high-resolution mass spectrometry (HRMS). The mzML format has been developed by the Human Proteome Organisation (HUPO) and allow to convert proprietary instrument files to an open format that can be used with the various numerical computing environment. Those datasets have been used in the development of the Finnee Matlab toolbox. The original Bruker file that was used to create the mzML files has been graciously donated by Alejandro Cifuentes from the Laboratory of Foodomics (CIAL, CSIC, Madrid, Spain).

本数据集包含经毛细管电泳-高分辨质谱（high-resolution mass spectrometry, HRMS）联用技术分离得到的尿液样本特征数据。mzML格式由人类蛋白质组组织（Human Proteome Organisation, HUPO）开发，可将专有仪器文件转换为可适配各类数值计算环境的开放格式。本数据集曾用于Finnee Matlab工具箱的开发工作。用于生成mzML文件的原始Bruker仪器文件，由西班牙马德里食品组学实验室（CIAL、CSIC）的Alejandro Cifuentes慷慨捐赠。