Converts a featureXML to a mProphet tsv.
Creates a new table with multiple conformers per input molecule.
Loads microbial data from a database
Applies a number of substructure filters to an input RDKit Mol column. Please use the RDKit Molecule Substructure Filter instead.
Correlate precursor masstraces with fragment ion masstraces in SWATH maps based on their elution profile.
Reads QC Ion injection time summary from a CSV file generated with the QCExporter.
Generate fingerprints for CDK molecules
Detects two-dimensional features in LC-MS data.
Calculates isobaric quantitative values for peptides
Applies a reaction to two RDKit Mol columns.
Do you have feedback, questions, comments about NodePit, want to support this platform, or want your own nodes or workflows listed here as well? Do you think, the search results could be improved or something is missing? Then please get in touch! Alternatively, you can send us an email to mail@nodepit.com.
Please note that this is only about NodePit. We do not provide general support for KNIME — please use the KNIME forums instead.