mineMS2: annotation of spectral libraries with exact fragmentation patterns
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DOI: 10.1186/s13321-025-01051-y
Abstract: Identification is a major challenge in metabolomics due to the large structural diversity of metabolites. Tandem mass spectrometry is a reference technology for studying the fragmentation of molecules and characterizing their structure. Recent instruments can… read more here.
Keywords: fragmentation; annotation spectral; spectral libraries; minems2 annotation ... See more keywords