There are 2933 nodes that can be used as successor
for a node with an output port of type Table.
Generates 2D coordinates for CDK cells
This node generates atom signatures describing the neighbourhood of individual atoms in CDK molecules.
DEPRECATED. NOT WORKING ANYMORE. Download molecular structures from ChemSpider.com.
Handles unconnected molecules
Depict CDK structures into images
Filters molecules by element type occurrence.
Calculates the Tanimoto similarity coefficient for two fingerprints of equal size.
Generate fingerprints for CDK molecules
Manipulates hydrogens of CDK molecules
Calculates the number failures of the Lipinski's Rule Of Five.