PMM Joiner 

Joins model formulas and data and assigns parameter symbols in formulas to parameter names in preparation for a model estimation

RDKit SDF Difference Checker 

Compares SDF strings of two columns and fails if differences are found.

Configurable IF/CASE Switch (Flow Variable Value) 

A configurable IF/CASE switch with changeable port types and varying number of outputs

Group Mutual Information 

Calculates mutual information between two groups.

Align pharmacophores 

Align query pharmacophores to reference pharmacophore.

SyGMa Metabolites 

Predict metabolites from parent molecules using Sygma (https://github.com/3D-e-Chem/sygma).

Dose Response (R) 

Calculates and visualizes dose response curves

Fix Column Names 

Renames column headers to obtain compatible column names for an R data-frame.

Load Layout 

Reads an Excel file containing a plate layout