polymerist.smileslib.special

Reference for “special” SMARTS queries not found on the periodic table

Attributes

`SPECIAL_QUERY_SMARTS`
`SPECIAL_QUERY_ATOMS`
`SPECIAL_QUERY_MOLS`
`query_atom`

Module Contents

polymerist.smileslib.special.SPECIAL_QUERY_SMARTS: dict[str, str]

polymerist.smileslib.special.SPECIAL_QUERY_ATOMS: dict[str, rdkit.Chem.rdchem.QueryAtom]

polymerist.smileslib.special.SPECIAL_QUERY_MOLS: dict[str, rdkit.Chem.rdchem.Mol]

polymerist.smileslib.special.query_atom