JaskRendix / Waters2mzML Star 0 Code Issues Pull requests Conversion and annotation pipeline for Waters .raw MS¹/MSⁿ data (MSe & DDA). Wraps msconvert, extracts _extern metadata, assigns MS levels, fixes precursor info, and outputs analysis‑ready .mzML files compatible with MZmine 3. conversion mass-spectrometry mzml qc metadata-validation msconvert proteowizard Updated May 25, 2026 Python