View secondary estimations and the associated model parameters
Applies a number of substructure filters to an input RDKit Mol column. Please use the RDKit Molecule Substructure Filter instead.
Generate molecule from pharmacophore
Scale intensities per spectrum to either sum to 1 or have a maximum of 1.
run SSH with stdin and out
Facilitate input to MaRaCluster and reintegrate.
Returns all matches of a regex to a collection column
Picks peaks and finds features in an SWATH-MS or SRM experiment.
Finds mass spectrometric peaks in profile mass spectra.
Annotates MS/MS spectra using Comet.
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.