11 #ifndef _HIERARCHCLUSTERPICKER_H 12 #define _HIERARCHCLUSTERPICKER_H 44 : d_method(clusterMethod) {
81 unsigned int pickSize)
const;
102 unsigned int pickSize)
const;
Diversity picker based on hierarchical clustering.
#define RDKIT_SIMDIVPICKERS_EXPORT
std::vector< INT_VECT > VECT_INT_VECT
std::vector< int > INT_VECT
Abstract base class to do perform item picking (typically molecules) using a distance matrix...
ClusterMethod
The type of hierarchical clustering algorithm to use.
HierarchicalClusterPicker(ClusterMethod clusterMethod)
Constructor - takes a ClusterMethod as an argument.