OEGetFPCoverageΒΆ

OESystem::OEIterBase<OEChem::OEAtomBondSet> *
  OEGetFPCoverage(const OEChem::OEMolBase &mol, const OEFPTypeBase *fptype,
                  bool unique=false)

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 OEGetFPCoverage function 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