This node returns the ring count of a SMILES Cell. More specifically, it returns the count of ring closure bonds. 'Broken' ring closure bonds (i.e. those with an end missing) will be flagged in the console log, and can be removed by pre-filtering with the 'Speedy SMILES Remove Broken Bonds' filter/splitter nodes
This node was developed by Vernalis Research . For feedback and more information, please contact knime@vernalis.com
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Popular Predecessors
- Row Filter17 %
- Smiles Directory Reader13 %
- Rule-based Row Filter13 %
- Speedy SMILES Element Count (C, N, O)6 %
- RDKit Molecule Extractor6 %
- Speedy SMILES Component Count4 %
- Speedy SMILES Heavy Atom Count (HAC)4 %
- Column List Loop Start3 %
Column Rename3 %- RDKit Substructure Filter3 %
Recursive Loop End3 %- RDKit Canon SMILES1 %
- Speedy SMILES Ring Count1 %
- Speedy SMILES De-salt1 %
- MarvinSketch1 %
Line Reader1 %- Concatenate1 %
- Column Filter1 %
- Row Splitter1 %
- Molecule Type Cast1 %
- OpenBabel1 %
- Java Snippet (simple)1 %
- Molecular Properties1 %
- RDKit Molecule Fragmenter1 %
- Row Sampling1 %
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