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/*=========================================================================
*
* Copyright NumFOCUS
*
* Licensed under the Apache License, Version 2.0 (the "License");
* you may not use this file except in compliance with the License.
* You may obtain a copy of the License at
*
* https://www.apache.org/licenses/LICENSE-2.0.txt
*
* Unless required by applicable law or agreed to in writing, software
* distributed under the License is distributed on an "AS IS" BASIS,
* WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied.
* See the License for the specific language governing permissions and
* limitations under the License.
*
*=========================================================================*/
#ifndef itkKdTreeBasedKmeansEstimator_h
#define itkKdTreeBasedKmeansEstimator_h
#include <vector>
#include <unordered_map>
#include "itkObject.h"
#include "itkEuclideanDistanceMetric.h"
#include "itkDistanceToCentroidMembershipFunction.h"
#include "itkSimpleDataObjectDecorator.h"
#include "itkNumericTraitsArrayPixel.h"
namespace itk
{
namespace Statistics
{
/**
* \class KdTreeBasedKmeansEstimator
* \brief fast k-means algorithm implementation using k-d tree structure
*
* It returns k mean vectors that are centroids of k-clusters
* using pre-generated k-d tree. k-d tree generation is done by
* the WeightedCentroidKdTreeGenerator. The tree construction needs
* to be done only once. The resulting k-d tree's non-terminal nodes
* that have their children nodes have vector sums of measurement vectors
* that belong to the nodes and the number of measurement vectors
* in addition to the typical node boundary information and pointers to
* children nodes. Instead of reassigning every measurement vector to
* the nearest cluster centroid and recalculating centroid, it maintain
* a set of cluster centroid candidates and using pruning algorithm that
* utilizes k-d tree, it updates the means of only relevant candidates at
* each iterations. It would be faster than traditional implementation
* of k-means algorithm. However, the k-d tree consumes a large amount
* of memory. The tree construction time and pruning algorithm's performance
* are important factors to the whole process's performance. If users
* want to use k-d tree for some purpose other than k-means estimation,
* they can use the KdTreeGenerator instead of the
* WeightedCentroidKdTreeGenerator. It will save the tree construction
* time and memory usage.
*
* Note: There is a second implementation of k-means algorithm in ITK under the
* While the Kd tree based implementation is more time efficient, the GLA/LBG
* based algorithm is more memory efficient.
*
* <b>Recent API changes:</b>
* The static const macro to get the length of a measurement vector,
* \c MeasurementVectorSize has been removed to allow the length of a measurement
* vector to be specified at run time. It is now obtained from the KdTree set
* as input. You may query this length using the function GetMeasurementVectorSize().
*
* \sa ImageKmeansModelEstimator
* \sa WeightedCentroidKdTreeGenerator, KdTree
* \ingroup ITKStatistics
*/
template <typename TKdTree>
class ITK_TEMPLATE_EXPORT KdTreeBasedKmeansEstimator : public Object
{
public:
/** Standard Self type alias. */
using Self = KdTreeBasedKmeansEstimator;
using Superclass = Object;
using Pointer = SmartPointer<Self>;
using ConstPointer = SmartPointer<const Self>;
/** Method for creation through the object factory. */
itkNewMacro(Self);
/** \see LightObject::GetNameOfClass() */
itkOverrideGetNameOfClassMacro(KdTreeBasedKmeansEstimator);
/** Types for the KdTree data structure */
using KdTreeNodeType = typename TKdTree::KdTreeNodeType;
using MeasurementType = typename TKdTree::MeasurementType;
using MeasurementVectorType = typename TKdTree::MeasurementVectorType;
using InstanceIdentifier = typename TKdTree::InstanceIdentifier;
using SampleType = typename TKdTree::SampleType;
using CentroidType = typename KdTreeNodeType::CentroidType;
/** Typedef for the length of a measurement vector */
using MeasurementVectorSizeType = unsigned int;
/** Parameters type.
* It defines a position in the optimization search space. */
using ParameterType = Array<double>;
using InternalParametersType = std::vector<ParameterType>;
using ParametersType = Array<double>;
/** Typedef required to generate dataobject decorated output that can
* be plugged into SampleClassifierFilter */
using DistanceToCentroidMembershipFunctionType = DistanceToCentroidMembershipFunction<MeasurementVectorType>;
using DistanceToCentroidMembershipFunctionPointer = typename DistanceToCentroidMembershipFunctionType::Pointer;
using MembershipFunctionType = MembershipFunctionBase<MeasurementVectorType>;
using MembershipFunctionPointer = typename MembershipFunctionType::ConstPointer;
using MembershipFunctionVectorType = std::vector<MembershipFunctionPointer>;
using MembershipFunctionVectorObjectType = SimpleDataObjectDecorator<MembershipFunctionVectorType>;
using MembershipFunctionVectorObjectPointer = typename MembershipFunctionVectorObjectType::Pointer;
/** Output Membership function vector containing the membership functions with
* the final optimized parameters */
const MembershipFunctionVectorObjectType *
GetOutput() const;
/** Set the position to initialize the optimization. */
itkSetMacro(Parameters, ParametersType);
itkGetConstMacro(Parameters, ParametersType);
/** Set/Get maximum iteration limit. */
itkSetMacro(MaximumIteration, int);
itkGetConstMacro(MaximumIteration, int);
/** Set/Get the termination threshold for the squared sum
* of changes in centroid positions after one iteration */
itkSetMacro(CentroidPositionChangesThreshold, double);
itkGetConstMacro(CentroidPositionChangesThreshold, double);
/** Set/Get the pointer to the KdTree */
void
SetKdTree(TKdTree * tree);
const TKdTree *
GetKdTree() const;
/** Get the length of measurement vectors in the KdTree */
itkGetConstMacro(MeasurementVectorSize, MeasurementVectorSizeType);
itkGetConstMacro(CurrentIteration, int);
itkGetConstMacro(CentroidPositionChanges, double);
/** Start optimization
* Optimization will stop when it meets either of two termination conditions,
* the maximum iteration limit or epsilon (minimal changes in squared sum
* of changes in centroid positions) */
void
StartOptimization();
using ClusterLabelsType = std::unordered_map<InstanceIdentifier, unsigned int>;
itkSetMacro(UseClusterLabels, bool);
itkGetConstMacro(UseClusterLabels, bool);
itkBooleanMacro(UseClusterLabels);
protected:
KdTreeBasedKmeansEstimator();
~KdTreeBasedKmeansEstimator() override = default;
void
PrintSelf(std::ostream & os, Indent indent) const override;
void
FillClusterLabels(KdTreeNodeType * node, int closestIndex);
/**
* \class CandidateVector
* \brief Candidate Vector
* \ingroup ITKStatistics
*/
class CandidateVector
{
public:
CandidateVector() = default;
struct Candidate
{
CentroidType Centroid;
CentroidType WeightedCentroid;
int Size;
}; // end of struct
virtual ~CandidateVector() = default;
/** returns the number of candidate = k */
int
Size() const
{
return static_cast<int>(m_Candidates.size());
}
/** Initialize the centroids with the argument.
* At each iteration, this should be called before filtering. */
void
SetCentroids(InternalParametersType & centroids)
{
this->m_MeasurementVectorSize = NumericTraits<ParameterType>::GetLength(centroids[0]);
m_Candidates.resize(centroids.size());
for (unsigned int i = 0; i < centroids.size(); ++i)
{
Candidate candidate;
candidate.Centroid = centroids[i];
NumericTraits<CentroidType>::SetLength(candidate.WeightedCentroid, m_MeasurementVectorSize);
candidate.WeightedCentroid.Fill(0.0);
candidate.Size = 0;
m_Candidates[i] = candidate;
}
}
/** gets the centroids (k-means) */
void
GetCentroids(InternalParametersType & centroids)
{
unsigned int i;
centroids.resize(this->Size());
for (i = 0; i < static_cast<unsigned int>(this->Size()); ++i)
{
centroids[i] = m_Candidates[i].Centroid;
}
}
/** updates the centroids using the vector sum of measurement vectors
* that belongs to each centroid and the number of measurement vectors */
void
UpdateCentroids()
{
unsigned int i, j;
for (i = 0; i < static_cast<unsigned int>(this->Size()); ++i)
{
if (m_Candidates[i].Size > 0)
{
for (j = 0; j < m_MeasurementVectorSize; ++j)
{
m_Candidates[i].Centroid[j] =
m_Candidates[i].WeightedCentroid[j] / static_cast<double>(m_Candidates[i].Size);
}
}
}
}
/** gets the index-th candidates */
Candidate & operator[](int index) { return m_Candidates[index]; }
private:
/** internal storage for the candidates */
std::vector<Candidate> m_Candidates;
/** Length of each measurement vector */
MeasurementVectorSizeType m_MeasurementVectorSize{ 0 };
}; // end of class
/** gets the sum of squared difference between the previous position
* and current position of all centroid. This is the primary termination
* condition for this algorithm. If the return value is less than
* the value that was set by the SetCentroidPositionChangesThreshold
* method. */
double
GetSumOfSquaredPositionChanges(InternalParametersType & previous, InternalParametersType & current);
/** get the index of the closest candidate to the measurements
* measurement vector */
int
GetClosestCandidate(ParameterType & measurements, std::vector<int> & validIndexes);
/** returns true if the pointA is farther than pointB to the boundary */
bool
IsFarther(ParameterType & pointA,
ParameterType & pointB,
MeasurementVectorType & lowerBound,
MeasurementVectorType & upperBound);
/** recursive pruning algorithm. the validIndexes vector contains
* only the indexes of the surviving candidates for the node */
void
Filter(KdTreeNodeType * node,
std::vector<int> validIndexes,
MeasurementVectorType & lowerBound,
MeasurementVectorType & upperBound);
/** copies the source parameters (k-means) to the target */
void
CopyParameters(InternalParametersType & source, InternalParametersType & target);
/** copies the source parameters (k-means) to the target */
void
CopyParameters(ParametersType & source, InternalParametersType & target);
/** copies the source parameters (k-means) to the target */
void
CopyParameters(InternalParametersType & source, ParametersType & target);
/** imports the measurements measurement vector data to the point */
void
GetPoint(ParameterType & point, MeasurementVectorType measurements);
void
PrintPoint(ParameterType & point);
private:
/** current number of iteration */
int m_CurrentIteration{ 0 };
/** maximum number of iteration. termination criterion */
int m_MaximumIteration{ 100 };
/** sum of squared centroid position changes at the current iteration */
double m_CentroidPositionChanges{ 0.0 };
/** threshold for the sum of squared centroid position changes.
* termination criterion */
double m_CentroidPositionChangesThreshold{ 0.0 };
/** pointer to the k-d tree */
typename TKdTree::Pointer m_KdTree{};
/** pointer to the euclidean distance function */
typename EuclideanDistanceMetric<ParameterType>::Pointer m_DistanceMetric{};
/** k-means */
ParametersType m_Parameters{};
CandidateVector m_CandidateVector{};
ParameterType m_TempVertex{};
bool m_UseClusterLabels{ false };
bool m_GenerateClusterLabels{ false };
ClusterLabelsType m_ClusterLabels{};
MeasurementVectorSizeType m_MeasurementVectorSize{ 0 };
MembershipFunctionVectorObjectPointer m_MembershipFunctionsObject{};
}; // end of class
} // end of namespace Statistics
} // end of namespace itk
#ifndef ITK_MANUAL_INSTANTIATION
# include "itkKdTreeBasedKmeansEstimator.hxx"
#endif
#endif
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