Uses of Class
com.actelion.research.chem.descriptor.flexophore.redgraph.SubGraphIndices
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Packages that use SubGraphIndices Package Description com.actelion.research.chem.descriptor.flexophore.redgraph -
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Uses of SubGraphIndices in com.actelion.research.chem.descriptor.flexophore.redgraph
Methods in com.actelion.research.chem.descriptor.flexophore.redgraph that return types with arguments of type SubGraphIndices Modifier and Type Method Description java.util.List<SubGraphIndices>
SubGraphExtractor. extract(StereoMolecule molOrig)
Delivers a list of indices that describes sub structures of the given molecule.java.util.List<SubGraphIndices>
SubGraphExtractor. extractAliphaticRingsAndEndStandingAliphaticGroups(StereoMolecule molOrig)
static java.util.Comparator<SubGraphIndices>
SubGraphIndices. getComparatorNumIndices()
static java.util.List<SubGraphIndices>
SubGraphIndices. mergeOverlapping(java.util.List<SubGraphIndices> liFragment, int minNumIndicesOverlapping)
Merges overlapping fragments.Methods in com.actelion.research.chem.descriptor.flexophore.redgraph with parameters of type SubGraphIndices Modifier and Type Method Description int
SubGraphIndices. getNumOverlappingIndices(SubGraphIndices frag)
boolean
SubGraphIndices. isOverlap(SubGraphIndices frag)
void
SubGraphIndices. merge(SubGraphIndices frag)
Method parameters in com.actelion.research.chem.descriptor.flexophore.redgraph with type arguments of type SubGraphIndices Modifier and Type Method Description protected static void
SubGraphIndices. addAtomIndices(HashSetInt hs, java.util.List<SubGraphIndices> liFragment)
Adds the atom indices to the hash set.static void
SubGraphIndices. merge(java.util.List<SubGraphIndices> liFragment)
Merges fragments containing a common atom index.static java.util.List<SubGraphIndices>
SubGraphIndices. mergeOverlapping(java.util.List<SubGraphIndices> liFragment, int minNumIndicesOverlapping)
Merges overlapping fragments.
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