Statistical Analysis of Feature-based Molecular Networking Results from Non-Targeted Metabolomics Data

This folder contains the following used for the publication: MASSIVE Repositories: MSV000082312 and MSV000085786. This contains the original data in both .raw and .mzxml formats. MZmine 3 files: The feature table (SD_BeachSurvey_GapFilled_quant.csv), the associated mgf file, the batch file (.xml) used for MZmine 3 to obtain the feature table, the mgf file for SIRIUS annotations (SD_BeachSurvey_SIRIUS_fixed.mgf) SIRIUS and CANOPUS summary files (.tsv files) FBMN Result files