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Philippine Louail

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#software testing Open access Sep 2026

jorainer/xcms4gnps2: xcms-based LC-MS/MS data preprocessing for FBMN with GNPS, version 1.1.3

An example workflow for preprocessing of a (public) example LC-MS/MS data set in R using the xcms Bioconductor package for a subsequent feature-based molecular networking (FBMN) with GNPS2. The GitHub repository contains the source code as well as pre-rendered html version of the workflow. The workflow is completely re...

Johannes Rainer, Philippine Louail · 0 citations

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