GPCRDB Protein similarity 

Get similarity of query against subjects

GNPSExport 

Export representative consensus MS/MS scan per consensusElement into a .MGF file format. See the documentation on […]

SpecLibSearcher 

Identifies peptide MS/MS spectra by spectral matching with a searchable spectral library.

IDScoreSwitcher 

Switches between different scores of peptide or protein hits in identification data

RDKit Molecule Substructure Filter 

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

QCMerger 

Merges two qcml files together.

FSK Metadata Editor Deprecated

Edit the metadata in an FSK object

RDKit Dictionary Substructure Filter (deprecated) Deprecated

Applies a number of substructure filters to an input RDKit Mol column. Please use the RDKit Molecule Substructure Filter instead.