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#ifndef APPLICATIONS_STATICPROPS_GOFANGLE2_HPP |
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#define APPLICATIONS_STATICPROPS_GOFANGLE2_HPP |
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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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class GofRAngle2 : public RadialDistrFunc { |
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class GofAngle2 : public RadialDistrFunc { |
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public: |
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GofRAngle2(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2); |
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public: |
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GofAngle2(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2, int nangleBins); |
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void setNAngleBins(int nbins) { |
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assert(nbins >0); |
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nAngleBins_ = nbins; |
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deltaCosAngle_ = 2.0 / nAngleBins_; |
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for (int i = 0 ; i < nAngleBins_; ++i) { |
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histogram_[i].resize(nAngleBins_); |
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avgGofr_[i].resize(nAngleBins_); |
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} |
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} |
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int getNAngleBins() {return nAngleBins_;} |
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int getNAngleBins() {return nAngleBins_;} |
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private: |
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private: |
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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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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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virtual void writeRdf(); |
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virtual void writeRdf(); |
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double deltaCosAngle_; |
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int nAngleBins_; |
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RealType deltaCosAngle_; |
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int nAngleBins_; |
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std::vector<std::vector<int> > histogram_; |
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std::vector<std::vector<int> > avgGofr_; |
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int npairs_; |
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}; |
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std::vector<std::vector<int> > histogram_; |
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std::vector<std::vector<int> > avgGofr_; |
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int npairs_; |
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}; |
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} |
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#endif |
