Metabolite_Adduct_Grouping

Uses accurate mass based on multiple adduct grouping steps (adducts, neutral losses).

Example input data:
To download the data from the archive, check the box on the folder and click on the download button (arrow) on the top left.
Download and unpack the "Metabolomics" data into a directory "Example_data/Metabolomics" next to this workflow inside your KNIME workspace.

External resources

• Example Data
• Home of the OpenMS plugin