@Deprecated public class MoleculeSignatureLabellingAdaptor extends Object implements ICanonicalMoleculeLabeller
Constructor and Description |
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MoleculeSignatureLabellingAdaptor()
Deprecated.
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Modifier and Type | Method and Description |
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IAtomContainer |
getCanonicalMolecule(IAtomContainer container)
Deprecated.
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int[] |
getCanonicalPermutation(IAtomContainer container)
Deprecated.
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public MoleculeSignatureLabellingAdaptor()
public IAtomContainer getCanonicalMolecule(IAtomContainer container)
getCanonicalMolecule
in interface ICanonicalMoleculeLabeller
public int[] getCanonicalPermutation(IAtomContainer container)
getCanonicalPermutation
in interface ICanonicalMoleculeLabeller
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