PDB SMILES Query StreamableDeprecated

Node to perform SMILES string queries using the PDB smilesQuery webservice

R Plot 

Creates plot with R.

MMP Show Matching Bonds (RDKit) Streamable

This node renders all bonds matching the indicated bond type

MMP Molecule Filter (RDKit) Streamable

This node prefilters molecules prior to Matched Pair Finding

MMP Molecule Splitter (RDKit) Streamable

This node prefilters molecules prior to Matched Pair Finding

Conformal Predictor and Classifier (Regression) Streamable

The node returns the prediction of conformal regression model based on the regression model and conformal regression calibration table.

Automated Matched Pairs 

Detects single-point changes within a chemical data set and outputs an SAR table.

Formula Filter 

2D/3D Scatterplot 

XLS Sheet Selector 

The XLS Sheet Selector node specifies the target XLS sheet for further XLS formatting instructions.