OEGetFPCoverage
OEGetFPCoverage(mol: Union[OEGraphMol,OEMol,OEQMol],
fptype: OEFPTypeBase, unique: bool = False) -> OEAtomBondSetIter
Returns an iterator over the fragments that are generated when a fingerprint is constructed.
- mol
The OEMolBase objects from which the fingerprint fragments are generated.
- fptype
The type of the fingerprint that also stores the parameters that are used when the fingerprint is generated.
- unique
If true, then the
OEGetFPCoveragefunction returns only unique fragments. A fragment (i.e. a subgraph) is considered unique if it differs from all other subgraphs identified previously by at least one atom or bond.
Note
The OEGetFPCoverage function is not
available for the OEFPType_Lingo
fingerprint type.
See also
Fingerprint Coverage chapter
OEGetFPOverlapfunctionOEGetFPPatternsfunction