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Packages that use ExtendedAtomAndBondTyper | |
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fingerprinters |
Uses of ExtendedAtomAndBondTyper in fingerprinters |
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Methods in fingerprinters that return ExtendedAtomAndBondTyper | |
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ExtendedAtomAndBondTyper |
EncodingFingerprint.getTyper()
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Methods in fingerprinters with parameters of type ExtendedAtomAndBondTyper | |
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java.util.List<IFeature> |
CombinatorialPatternHelper.getFingerprint2Point(org.openscience.cdk.interfaces.IAtomContainer ac,
int[][] matrix,
int distanceCutoff,
ExtendedAtomAndBondTyper typer)
generates all possible patters between two atoms |
java.util.List<IFeature> |
CombinatorialPatternHelper.getFingerprint3Point(org.openscience.cdk.interfaces.IAtomContainer ac,
int[][] matrix,
int distanceCutoff,
ExtendedAtomAndBondTyper typer)
generates all possible patterns between three atoms |
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