Package chemCast.similarity.data

Interface Summary
IChemCastList  
IChemCastObject  
 

Class Summary
AtomEnvironmentSimilarity Calculates set of consensus atom environments and calculates Hellinger distance between query compound and consensus a.e.
ChemCastDescriptor  
ChemCastDescriptorsList  
ChemCastObject  
ChemCastObjectFactory  
Dataset  
DatasetDef  
DefaultChemCastEditor  
DescriptorSelection  
Endpoint  
Endpoints TODO add description
FingerprintSimilaritySubsets  
MCSSSimilarity  
NearestNeighborsSimilaritySubsets<T>  
NN_MCSSSimilarity  
NNAtomEnvironmentSimilaritySubsets  
NNFingerprintSimilaritySubsets  
SimilarityDef  
SimilarityDefEditor  
SimilarityDefs  
SimilarityModel  
SimilarityModels  
SimilaritySubsets  
Subset  
Subsets  
SubsetSimilarityMatrix  
ToxTreeSimilarity