Interface ICanonicalMoleculeLabeller
- All Known Implementing Classes:
CanonicalLabellingAdaptor
,MoleculeSignatureLabellingAdaptor
Deprecated.
This class is part of SMSD and either duplicates functionality elsewhere in the CDK or provides public
access to internal implementation details. SMSD has been deprecated from the CDK with a newer, more recent
version of SMSD is available at http://github.com/asad/smsd.
- Source code:
- main
- Belongs to CDK module:
- smsd
-
Method Summary
Modifier and TypeMethodDescriptiongetCanonicalMolecule
(IAtomContainer container) Deprecated.int[]
getCanonicalPermutation
(IAtomContainer container) Deprecated.
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Method Details
-
getCanonicalMolecule
Deprecated. -
getCanonicalPermutation
Deprecated.
-