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#ifndef APPLICATIONS_STATICPROPS_RADIALDISTRFUNC_HPP |
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#define APPLICATIONS_STATICPROPS_RADIALDISTRFUNC_HPP |
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#include <string> |
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#include <vector> |
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#include "selection/SelectionEvaluator.hpp" |
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#include "selection/SelectionManager.hpp" |
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#include "utils/NumericConstant.hpp" |
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#include "applications/staticProps/StaticAnalyser.hpp" |
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namespace oopse { |
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/** |
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* @class RadialDistrFunc |
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* @brief Radial Distribution Function |
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*/ |
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class RadialDistrFunc { |
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public: |
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RadialDistrFunc(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2. double len); |
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/** |
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* @class RadialDistrFunc |
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* @brief Radial Distribution Function |
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*/ |
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class RadialDistrFunc : public StaticAnalyser { |
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public: |
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RadialDistrFunc(SimInfo* info, const std::string& filename, const std::string& sele1, const std::string& sele2); |
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void process(); |
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virtual ~RadialDistrFunc() {} |
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void process(); |
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void setNBins(int nbins) { |
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assert(nbins > 0); |
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nbins_ = nbins; |
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delta_ = len_ / nbins_; |
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} |
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int getNBins() { |
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return nbins_; |
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} |
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void setOutputName(const std::string& filename) { |
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outputFilename_ = filename; |
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} |
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protected: |
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const std::string& getOutputFileName() const { |
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return outputFilename_; |
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} |
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virtual void preProcess() {} |
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virtual void postProcess() {} |
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void setStep(int step) { |
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assert(step > 0); |
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step_ =step; |
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} |
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int getNPairs() { return nPairs_;} |
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protected: |
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Snapshot* currentSnapshot_; |
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virtual void preProcess() {} |
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virtual void postProcess() {} |
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SimInfo* info_; |
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Snapshot* currentSnapshot_; |
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double len_; |
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int nbins_; |
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double delta_; |
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std::string dumpFilename_; |
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std::string outputFilename_; |
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int step_; |
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std::string selectionScript1_; |
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std::string selectionScript2_; |
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std::string selectionScript1_; |
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std::string selectionScript2_; |
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int nProcessed_; |
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SelectionManager seleMan1_; |
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SelectionManager seleMan2_; |
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private: |
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private: |
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virtual void initalizeHistogram() {} |
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virtual void collectHistogram(StuntDouble* sd1, StuntDouble* sd2) =0; |
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virtual void processHistogram() = 0; |
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virtual void initalizeHistogram() {} |
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virtual void collectHistogram(StuntDouble* sd1, StuntDouble* sd2) =0; |
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virtual void processHistogram() {} |
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void processNonOverlapping(SelectionManager& sman1, SelectionManager& sman2); |
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void processOverlapping(SelectionManager& sman); |
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virtual void writeRdf() = 0; |
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virtual void validateSelection1(SelectionManager& sman) {} |
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virtual void validateSelection2(SelectionManager& sman) {} |
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virtual void writeRdf() = 0; |
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SelectionEvaluator evaluator1_; |
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SelectionEvaluator evaluator2_; |
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SelectionManager seleMan1_; |
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SelectionManager seleMan2_; |
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}; |
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SelectionEvaluator evaluator1_; |
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SelectionEvaluator evaluator2_; |
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SelectionManager sele1_minus_common_; |
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SelectionManager sele2_minus_common_; |
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SelectionManager common_; |
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int nPairs_; |
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}; |
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} |
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#endif |
