This Node Is Deprecated — This version of the node has been replaced with a new and improved version. The old version is kept for backwards-compatibility, but for all new workflows we suggest to use the version linked below.
Go to Suggested ReplacementRDKit Fingerprint WriterThis node writes an FPS file using fingerprints from DenseBitVector cells of an input table. If the file exists already it will not be overridden by default. The format of the FPS file is mentioned here: https://jcheminf.springeropen.com/articles/10.1186/1758-2946-5-S1-P36
Options
Popular Predecessors
- RDKit Fingerprint22 %
RDKit Fingerprint Reader10 %- RDKit Count-Based Fingerprint7 %
- Column Filter6 %
- Fingerprints5 %
- RDKit Descriptor Calculation5 %
Column Rename5 %- RDKit From Molecule4 %
- RDKit Interactive Table3 %
- Molecule Type Cast3 %
File Reader2 %- RDKit Canon SMILES2 %
- Fingerprint From Hexadecimal String2 %
Fingerprint Properties2 %- Column Combiner2 %
- Fingerprint Similarity Calculator< 1 %
- Concatenate< 1 %
- Row Filter< 1 %
- SDF Reader< 1 %
- Dense To Sparse< 1 %
- Fingerprint From String< 1 %
- Fingerprints Expander< 1 %
Table Column to Variable< 1 %Table Row to Variable< 1 %CSV Reader< 1 %- Create Bit Vector< 1 %
- Column Resorter< 1 %
- Duplicate Row Filter< 1 %
Joiner< 1 %- Column Filter (PMML)< 1 %
- Column Splitter< 1 %
Excel Reader (XLS)< 1 %- RDKit Add Conformers< 1 %
- RDKit Diversity Picker< 1 %
- RDKit Molecule Extractor< 1 %
- RDKit SMILES Headers< 1 %
- Sorter< 1 %
- Column Filter (legacy)< 1 %
- Fingerprint Similarity< 1 %
- RDKit Add Hs< 1 %
- RDKit To Molecule< 1 %
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