RDKit R-Group Decomposition (deprecated)

Does an R-Group decomposition for an input RDKit Mol column. It is planned to deprecate this node soon, so that it cannot be used in new workflows anymore. It will be replaced by a new one developed based on RDKit functionality that was added in 2018/2019.

Options

RDKit Mol column
The column containing molecules.
Core SMARTS
A SMARTS describing the core to use.

Input Ports

Icon
Data with SMILES or RDKit Molecule column

Output Ports

Icon
Table with R groups added

Popular Predecessors

Views

This node has no views

Workflows

Links

Developers

You want to see the source code for this node? Click the following button and we’ll use our super-powers to find it for you.