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* University of Notre Dame has been advised of the possibility of |
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* such damages. |
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*/ |
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< |
#ifndef APPLICATIONS_STATICPROPS_GOFANGLE_HPP |
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< |
#define APPLICATIONS_STATICPROPS_GOFANGLE_HPP |
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> |
#ifndef APPLICATIONS_STATICPROPS_GOFRANGLE_HPP |
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> |
#define APPLICATIONS_STATICPROPS_GOFRANGLE_HPP |
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|
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< |
#include "application/staticProps/RadialDistrFunc.hpp" |
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> |
#include "applications/staticProps/RadialDistrFunc.hpp" |
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namespace oopse { |
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|
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< |
class GofRAngle : public RadialDistrFunc { |
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> |
class GofRAngle : public RadialDistrFunc { |
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|
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< |
public: |
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< |
GofRAngle(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2, double len); |
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> |
public: |
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> |
GofRAngle(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2, double len, int nrbins, int nangleBins); |
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|
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< |
private: |
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> |
int getNRBins() { |
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> |
return nRBins_; |
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> |
} |
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|
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< |
virtual void preProcess(); |
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< |
virtual void initalizeHistogram(); |
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< |
virtual void collectHistogram(StuntDouble* sd1, StuntDouble* sd2); |
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< |
virtual void processHistogram(); |
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> |
double getLength() { |
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> |
return len_; |
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> |
} |
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|
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< |
virtual double evaluateAngel(StuntDouble* sd1, StuntDouble* sd2) = 0; |
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< |
|
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< |
virtual void writeRdf(); |
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> |
int getNAngleBins() {return nAngleBins_;} |
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|
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< |
std::vector<std::vector<int> > histogram_; |
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< |
std::vector<std::vector<double> > avgGofr_; |
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< |
int npairs_; |
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< |
}; |
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> |
private: |
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|
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+ |
virtual void preProcess(); |
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+ |
virtual void initalizeHistogram(); |
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+ |
virtual void collectHistogram(StuntDouble* sd1, StuntDouble* sd2); |
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+ |
virtual void processHistogram(); |
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|
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< |
class GofRTheta : GofRAngle { |
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< |
public: |
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< |
GofRTheta(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2, double len); |
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> |
virtual double evaluateAngle(StuntDouble* sd1, StuntDouble* sd2) = 0; |
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|
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< |
private: |
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> |
virtual void writeRdf(); |
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|
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< |
virtual double evaluateAngel(StuntDouble* sd1, StuntDouble* sd2) = 0; |
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< |
}; |
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> |
double deltaCosAngle_; |
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> |
int nAngleBins_; |
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> |
double len_; |
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> |
int nRBins_; |
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> |
double deltaR_; |
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> |
|
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> |
std::vector<std::vector<int> > histogram_; |
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> |
std::vector<std::vector<double> > avgGofr_; |
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> |
int npairs_; |
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> |
}; |
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|
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|
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< |
class GofROmega : GofRAngle { |
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< |
public: |
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< |
GofROmega(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2, double len); |
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> |
class GofRTheta : public GofRAngle { |
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> |
public: |
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> |
GofRTheta(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2, double len, int nrbins, int nangleBins) |
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> |
: GofRAngle (info, filename, sele1, sele2, len, nrbins, nangleBins) { |
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> |
setOutputName(getPrefix(filename) + ".gofrt"); |
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> |
} |
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> |
|
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> |
private: |
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|
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< |
private: |
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> |
virtual double evaluateAngle(StuntDouble* sd1, StuntDouble* sd2); |
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> |
}; |
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|
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– |
virtual double evaluateAngel(StuntDouble* sd1, StuntDouble* sd2) = 0; |
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– |
}; |
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|
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+ |
class GofROmega : public GofRAngle { |
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+ |
public: |
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+ |
GofROmega(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2, double len, int nrbins, int nangleBins) |
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+ |
: GofRAngle (info, filename, sele1, sele2, len, nrbins, nangleBins) { |
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+ |
setOutputName(getPrefix(filename) + ".gofro"); |
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+ |
} |
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+ |
|
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+ |
private: |
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+ |
virtual double evaluateAngle(StuntDouble* sd1, StuntDouble* sd2); |
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+ |
}; |
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+ |
|
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} |
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#endif |
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|
