bioconductor-metcirc
Navigating mass spectral similarity in high-resolution MS/MS metabolomics data metabolomics data
Navigating mass spectral similarity in high-resolution MS/MS metabolomics data metabolomics data
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MetCirc comprises a workflow to interactively explore high-resolution MS/MS metabolomics data. MetCirc uses the Spectra object infrastructure defined in the package Spectra that stores MS/MS spectra. MetCirc offers functionality to calculate similarity between precursors based on the normalised dot product, neutral losses or user-defined functions and visualise similarities in a circular layout. Within the interactive framework the user can annotate MS/MS features based on their similarity to (known) related MS/MS features.
Summary
Navigating mass spectral similarity in high-resolution MS/MS metabolomics data metabolomics data
Last Updated
Dec 20, 2024 at 00:00
License
GPL (>= 3)
Total Downloads
40.9K
Supported Platforms
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