Subfamily specific two entropy analysis score.
Computes various properties for polygons.
Scores potential phosphorylation sites in order to localize the most probable sites.
Assay library generation from a SIRIUS project directory (Metabolomics)
Get information on a protein
Prints the content of OpenMS' enzyme and modification databases to TSV
Exports various XML formats to a text file.
Generates RDKit molecules from a molecule string representation (SMILES, SDF or SMARTS).
Calculates the multivariate z-prime coefficients for all combinations of a selection of negative and a selection of positive controls over a […]
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