Triazole_library
<p>This workflow generates a virtual library of triazole derivatives using click-chemistry transformations. It supports the enumeration of three major triazole classes:</p><ul><li><p>1,4-disubstituted triazoles (CuAAC-type reactions)</p></li><li><p>1,5-disubstituted triazoles (RuAAC-type reactions)</p></li><li><p>Triazoles derived from internal alkynes</p></li></ul>
This workflow generates a virtual library of triazole derivatives using click-chemistry transformations. It supports the enumeration of three major triazole classes:
1,4-disubstituted triazoles (CuAAC-type reactions)
1,5-disubstituted triazoles (RuAAC-type reactions)
Triazoles derived from internal alkynes
Nodes
- Molecule Type Cast4 ×
- Molecule Widget4 ×
- Variable to Table Row4 ×
- Constant Value Column Appender3 ×
- Group Loop Start3 ×
- Loop End3 ×
- RDKit From Molecule3 ×
- RDKit Two Component Reaction3 ×
- Column Filter2 ×
- RDKit To Molecule2 ×
- Column Resorter1 ×
- Concatenate1 ×
- Duplicate Row Filter1 ×
- RDKit Descriptor Calculation1 ×
- RDKit Molecule Catalog Filter1 ×
- RDKit Salt Stripper1 ×
- RDKit Substructure Filter1 ×
- Row Filter1 ×
- SDF Reader1 ×
- SDF Writer1 ×
Extensions
- FeatureKNIME Base Chemistry Types & Nodes
- FeatureKNIME Base nodes
- FeatureKNIME Quick Forms
- FeatureRDKit Nodes Feature
Links
- No links available