Package | Description |
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uk.ac.ebi.reactionblast.signature |
Modifier and Type | Method and Description |
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RBlastSmilesGenerator |
RBlastSmilesGenerator.setRings(org.openscience.cdk.interfaces.IRingSet rings)
Provide a reference to a RingSet that holds ALL rings of the
molecule.
During creation of a SMILES the aromaticity of the molecule has to be detected. |