Auditable desktop workflow for Progenesis QI LC–MS/MS curation: six-file reconciliation, QC-aware filtering, MS² evidence, repeated-identity resolution, chemistry/context scoring, and journal-ready exports
python-script python3 bioinformatics-pipeline metabolomics mass-spectrometry lipidomics bioinformatics-algorithms omics-data-integration scientific-software bioinformatics-tool research-software metabolomics-pipeline omics-analysis compound-identification pyside6-gui compound-curation lcms-ms reproducible-research-workflow cheminformatics-qsar-rdkit progenesis-qi
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Updated
Aug 14, 2026 - Python