This node returns the heavy atom count of a SMILES Cell.
This node was developed by Vernalis Research . For feedback and more information, please contact knime@vernalis.com
Options
Popular Successors
- Joiner6 %
- Row Splitter5 %
- Rank5 %
- Sorter5 %
- Row Filter4 %
- Speedy SMILES Heavy Atom Count (HAC)4 %
- RDKit Canon SMILES4 %
- Speedy SMILES Possible Stereoisomer Count4 %
- Column Filter3 %
- Rule-based Row Splitter3 %
Excel Writer (XLS)3 %- Speedy SMILES Element Count (C, N, O)3 %
- Java Snippet3 %
- Fingerprint Similarity3 %
- One Row to Many3 %
- Rule-based Row Filter3 %
- String Manipulation3 %
- Row Splitter (Labs)3 %
- Speedy SMILES Ring Count2 %
- Nominal Value Row Splitter2 %
- RDKit Count-Based Fingerprint2 %
- SDF Writer1 %
- Speedy SMILES Convert to Scaffold1 %
- Numeric Row Splitter1 %
- Math Formula1 %
- RDKit Fingerprint1 %
- Speedy SMILES Chiral Centre Count< 1 %
- Speedy SMILES Remove Broken Bonds Filter< 1 %
- Speedy SMILES Organic Subset Molecules Filter< 1 %
- Standardizer< 1 %
- XLS Coloured Writer< 1 %
Element Selector< 1 %- Group Loop Start< 1 %
- Filter Apply Row Splitter< 1 %
- GroupBy< 1 %
Column Rename< 1 %- Molecule Type Cast< 1 %
- Similarity Search< 1 %
- RDKit Descriptor Calculation< 1 %
- RDKit Salt Stripper< 1 %
- Speedy SMILES Component Count< 1 %
- Speedy SMILES Remove d-Block Metal-containing Molecules Filter< 1 %
- MolConverter< 1 %
- Table Writer< 1 %
- Constant Value Column< 1 %
- CASE Switch Start< 1 %
- Interactive Range Slider Filter Widget< 1 %
- Fingerprints< 1 %
- RDKit Molecule Catalog Filter< 1 %
Views
- This node has no views
Workflows
Links
- No links available
Developers
You want to see the source code for this node? Click the following button and we’ll use our super-powers to find it for you.