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Searched refs:AromaticityCalculator (Results 1 – 3 of 3) sorted by relevance

/dports/science/cdk/cdk-cdk-2.3/legacy/src/test/java/org/openscience/cdk/aromaticity/
H A DAromaticityCalculatorTest.java48 Assert.assertTrue(AromaticityCalculator.isAromatic((IRing) rs.getAtomContainer(0), mol)); in testIsAromatic_IRing_IAtomContainer()
/dports/science/cdk/cdk-cdk-2.3/legacy/src/main/java/org/openscience/cdk/aromaticity/
H A DAromaticityCalculator.java43 public class AromaticityCalculator { class
/dports/science/cdk/cdk-cdk-2.3/doc/
H A DCHANGELOG840 * Moved AromaticityCalculator from package smiles to aromaticity