FSK Joiner Deprecated

Joiner of FSK objects

ClusterMassTracesByPrecursor 

Correlate precursor masstraces with fragment ion masstraces in SWATH maps based on their elution profile.

StringCell To File Streamable

Writes the contents of a StringValue to a file

MRMMapper 

MRMMapper maps measured chromatograms (mzML) and the transitions used (TraML)

RDKit To Molecule Streamable

Converts RDKit molecules into string based molecule representations (SDF or Smiles).

Predictor View 

View models and predicted microbial concentrations

ChemSpider (deprecated) Deprecated

DEPRECATED. NOT WORKING ANYMORE. Download molecular structures from ChemSpider.com.

RDKit From IUPAC 

Converts IUPAC names to RDKit molecules.