searchSubstructure()
searchSubstructure(
column,pattern?,settings?):Promise<BitSet>
Defined in: src/chem.ts:766
Searches for a molecular pattern in a given column, returning a bitset with hits. See example: https://public.datagrok.ai/js/samples/domains/chem/substructure-search-library
Parameters
| Parameter | Type | Default value | Description |
|---|---|---|---|
column | Column | undefined | Column with molecules to search |
pattern | string | '' | Pattern, either one of which RDKit supports |
settings | { molBlockFailover?: string; } | {} | - |
settings.molBlockFailover? | string | undefined | - |
Returns
Promise<BitSet>