| canvasMol | Renders a molecule to canvas (using RdKit) |
| checkSmiles | - |
| convert | - |
| descriptors | Calculates specified descriptors for the molecular column. |
| descriptorsTree | Returns available descriptors tree. |
| diversitySearch | Returns the specified number of most diverse molecules in the column. |
| drawMolecule | - |
| findSimilar | Computes similarity scores for molecules in the input vector based on a preferred similarity score. |
| getSimilarities | Computes similarity scores for molecules in the input vector based on a preferred similarity score. |
| isMolBlock | - |
| isSmarts | - |
| mcs | Finds Most Common Substructure in the specified column. |
| rGroup | Performs R-group analysis. |
| searchSubstructure | Searches for a molecular pattern in a given column, returning a bitset with hits. |
| sketcher | Sketches Molecule sketcher. |
| smilesFromSmartsWarning | - |
| svgMol | Renders a molecule to SVG |