RDKit Molecule Substructure Filter 

Applies a number of substructure filters to an input RDKit Mol column.

DTAExtractor 

Extracts spectra of an MS run file to several files in DTA format.

IonMobilityBinning 

Splits an mzML file with IonMobility frames into multiple mzML files by binning(merging) spectra by their IM values

ProteinInference 

Protein inference based on an aggregation of the scores of the identified peptides.

Tertiary Model Selection 

View and select estimated primary or secondary models or combined models

RDKit To InChI Streamable

Converts RDKit molecules into InChI Codes and optionally also into InChI Keys.