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OpenMS
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Groups corresponding features from multiple maps using Wasserstein optimal transport.
| potential predecessor tools | → FeatureLinkerWNet → | potential successor tools |
|---|---|---|
| FeatureFinderCentroided (or another feature detection algorithm) | ProteinQuantifier | |
| MapAlignerPoseClustering (or another map alignment algorithm) | TextExporter |
This tool provides an algorithm for grouping corresponding features in multiple runs of label-free experiments using Wasserstein (optimal transport) distance. Features are matched by solving a minimum-cost network flow problem over their (m/z, RT) positions.
For more details and algorithm-specific parameters (set in the ini file) see "Detailed Description" in the algorithm documentation.
FeatureLinkerWNet takes several feature maps (featureXML files) and stores the corresponding features in a consensus map (consensusXML file). Feature maps can be created from MS experiments (peak data) using one of the FeatureFinder TOPP tools.
-DWITH_WNETALIGN=ON (off by default).