Node Connectivity

There are 4973 nodes that can be used as predessesor for a node with an input port of type Generic Port.

Element Filter 

Filters molecules by element type occurrence.

Fingerprint Similarity 

Calculates the Tanimoto similarity coefficient for two fingerprints of equal size.

Fingerprints 

Generate fingerprints for CDK molecules

Hydrogen Manipulator 

Manipulates hydrogens of CDK molecules

Lipinski's Rule-of-Five 

Calculates the number failures of the Lipinski's Rule Of Five.

Mass Calculator 

This node calculates the molecular mass or molar mass of a sum formula.

Molecular Properties 

Calculates molecular properties using CDK

OPSIN 

Retrieves various formats for a given molecule.

SMARTS Query 

Filters molecules based on a SMARTS search

Structure Sketcher 

Sketch a molecular structure