Perform a SMARTS substructure searches a SMILES chemical structure.
Usage
smartsSearch(SMILES, SMARTS)
Arguments
- SMILES
a valid SMILES structure string
- SMARTS
a valid SMARTS symbol
Value
The number of SMARTS matches.
Examples
smartsSearch("C[C@H](C(=O)O)N","[OX2H]")
#> [1] 1