RDKit Molecule Substructure Filter 

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

ss-TEA score 

Subfamily specific two entropy analysis score.

XFDR 

Calculates false discovery rate estimates on crosslink identifications

Filter and Appender Definer 

Defines a filter and appender model.

SSMD (PC x NC) 

Calculates SSMDs (strictly standardized mean difference) for all combinations of a selection of negative and a selection of positive controls.

Primary Model Selection 

View and select estimated primary models and associated microbial data

QCShrinker 

Remove unneeded or verbose table attachments from a qcml file.