ELSIE_vs_HuSSPRED_3D1
Nodes
- Column Filter39 ×
- Column Rename13 ×
- Rule Engine9 ×
- Rule-based Row Splitter9 ×
- Column Resorter8 ×
- Excel Reader7 ×
- Molecule Type Cast7 ×
- Column Renamer6 ×
- Python Script (legacy)6 ×
- Row Filter6 ×
- RowID6 ×
- String Manipulation6 ×
- Joiner5 ×
Cell Splitter4 ×- Chunk Loop Start4 ×
- Empty Table Switch4 ×
- End IF4 ×
- Joiner4 ×
- Loop End4 ×
- RDKit Descriptor Calculation4 ×
- RDKit From Molecule4 ×
- String Replacer4 ×
- Missing Value3 ×
- Column Rename (Regex)2 ×
- Column Splitter2 ×
- Concatenate2 ×
- GET Request2 ×
- GroupBy2 ×
- JSON Path2 ×
- MolConverter2 ×
- Nominal Row Filter Widget2 ×
- Number To String2 ×
- Python Script (2⇒1)2 ×
- RDKit Kekulizer2 ×
- RDKit Remove Hs2 ×
- RDKit Salt Stripper2 ×
- RDKit Structure Normalizer2 ×
- RDKit To InChI2 ×
- Speedy SMILES Clean Charges2 ×
- Speedy SMILES Clean Isotope Labels2 ×
- Speedy SMILES Remove d-Block Metal-containing Molecules Filter2 ×
- Speedy SMILES Remove f-block Metal-containing Molecules Filter2 ×
- Speedy SMILES Remove p-block Metal-containing Molecules Filter2 ×
- Speedy SMILES Strip Stereochemistry2 ×
- CIR1 ×
- Cell Splitter1 ×
- Column List Loop Start1 ×
- Column Selection Widget1 ×
- Domain Calculator1 ×
- Excel Writer1 ×
- Loop End (Column Append)1 ×
- Math Formula (Multi Column)1 ×
- Python Script (1⇒1)1 ×
- Save Workflow1 ×
- Scorer1 ×
- String To Number1 ×
Extensions
- FeatureChemAxon/Infocom Marvin Extensions Feature
- FeatureRDKit Nodes Feature
- FeatureVernalis KNIME Nodes
Links
- No links available