Article

Structural annotation of full-scan MS data: A unified solution for LC-MS and MS imaging analyses

2024-10-17

Abstract excerpt

Public liquid chromatography-mass spectrometry (LC-MS) and MS imaging metabolomics data repositories contain millions of files, with over 40% of them consisting solely of MS1 (full-scan) information, creating a significant gap in data reuse potential due to limited annotation capabilities. Here, we present ms1-id, an open-source Python package providing a unified solution for structural annotation of full-scan MS...

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Literature Corpus work: d5043817-86f0-50d0-8abe-8fbcff123885
DOI: 10.1101/2024.10.14.618269

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