Package | Description |
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org.openscience.cdk.inchi |
Class and Description |
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InChIGenerator
This class generates the IUPAC International Chemical Identifier (InChI) for
a CDK IAtomContainer.
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InChIGeneratorFactory
Factory providing access to
InChIGenerator and InChIToStructure . |
InChIToStructure
This class generates a CDK IAtomContainer from an InChI string.
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