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XCMS-MRM and METLIN-MRM: a cloud library and public resource for targeted analysis of small molecules
Nature Methods ( IF 48.0 ) Pub Date : 2018-08-27 , DOI: 10.1038/s41592-018-0110-3
Xavier Domingo-Almenara 1 , J Rafael Montenegro-Burke 1 , Julijana Ivanisevic 2 , Aurelien Thomas 3, 4 , Jonathan Sidibé 3, 4 , Tony Teav 2 , Carlos Guijas 1 , Aries E Aisporna 1 , Duane Rinehart 1 , Linh Hoang 1 , Anders Nordström 5 , María Gómez-Romero 6 , Luke Whiley 6 , Matthew R Lewis 6 , Jeremy K Nicholson 6 , H Paul Benton 1 , Gary Siuzdak 1, 7
Affiliation  

We report XCMS-MRM and METLIN-MRM (http://xcmsonline-mrm.scripps.edu/ and http://metlin.scripps.edu/), a cloud-based data-analysis platform and a public multiple-reaction monitoring (MRM) transition repository for small-molecule quantitative tandem mass spectrometry. This platform provides MRM transitions for more than 15,500 molecules and facilitates data sharing across different instruments and laboratories.



中文翻译:

XCMS-MRM 和 METLIN-MRM:用于小分子靶向分析的云库和公共资源

我们报告了 XCMS-MRM 和 METLIN-MRM(http://xcmsonline-mrm.scripps.edu/ 和 http://metlin.scripps.edu/),一个基于云的数据分析平台和公共多反应监测(MRM) 小分子定量串联质谱的转换库。该平台为超过 15,500 个分子提供 MRM 离子对,并促进不同仪器和实验室之间的数据共享。

更新日期:2018-08-27
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