matchms
作者 K-Dense-AI更新于 3 周前Spectral similarity and compound identification for metabolomics. Use for comparing mass spectra, computing similarity scores (cosine, modified cosine), and identifying unknown compounds from spectral libraries. Best for metabolite identification, spectral matching, library searching. For full LC-MS/MS proteomics pipelines use pyopenms.
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/plugin marketplace add K-Dense-AI/claude-scientific-skills