Combinatorial Reaction Enumeration (beta)

This node generates reactions by the specified reaction pattern and the input molecules. See the examples for more details.

Supported types:

• Query reaction: String, Rxn, Smiles, SMARTS

The node is based on the Indigo cheminformatics toolkit.

Input ports

1. Type: Table
   Reaction pattern
   Table with a single query reaction.
2. Type: Table
   Molecule set 1
   First molecules set
3. Type: Table
   Molecule set 2
   Optional second molecules set

Output ports

1. Type: Table
   Enumerated reactions
   Reactions generated by the specified reaction pattern and the input molecules