Speedy SMILES Possible Stereoisomer Count – KNIME Hub

Node / Manipulator

Speedy SMILES Possible Stereoisomer Count

Community Nodes Vernalis Speedy SMILES Properties Streamable

This node returns the possible stereoisomer count of a SMILES Cell, based on the explicitly defined chiral centres

This node was developed by Vernalis Research . For feedback and more information, please contact knime@vernalis.com

Node details

Ports Options Views

Input ports

Type: Table

SMILES Cells

Input Table containing a SMILES Column

Output ports

Type: Table

Stereoisomer Count

Count of possible stereoisomers

Extension

The Speedy SMILES Possible Stereoisomer Count node is part of this extension:

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