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| ActionCorrFunc (SimInfo *info, const std::string &filename, const std::string &sele1, const std::string &sele2) |
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| SystemACF (SimInfo *info, const std::string &filename, const std::string &sele1, const std::string &sele2) |
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| AutoCorrFunc (SimInfo *info, const std::string &filename, const std::string &sele1, const std::string &sele2) |
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| TimeCorrFunc (SimInfo *info, const std::string &filename, const std::string &sele1, const std::string &sele2) |
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virtual void | doCorrelate () |
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const std::string & | getCorrFuncType () const |
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void | setCorrFuncType (const std::string &type) |
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void | setParameterString (const std::string ¶ms) |
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void | setLabelString (const std::string &label) |
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void | setOutputName (const std::string &filename) |
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const std::string & | getOutputFileName () const |
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virtual void | computeProperty1 (int frame1) |
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Mat3x3d | calcCorrVal (int frame1, int frame2) |
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virtual int | computeProperty1 (int, Molecule *) |
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virtual int | computeProperty1 (int, StuntDouble *) |
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virtual int | computeProperty1 (int, Bond *) |
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Mat3x3d | calcCorrVal (int, int, int, int) |
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virtual void | computeProperty2 (int) |
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virtual int | computeProperty2 (int, Molecule *) |
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virtual int | computeProperty2 (int, StuntDouble *) |
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virtual int | computeProperty2 (int, Bond *) |
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virtual void | preCorrelate () |
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virtual void | correlation () |
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virtual void | postCorrelate () |
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virtual void | computeFrame (int frame) |
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virtual void | validateSelection (SelectionManager &seleMan) |
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virtual void | correlateFrames (int frame1, int frame2, int timeBin) |
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virtual void | writeCorrelate () |
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void | writeCorrelate () |
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void | writeCorrelate () |
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Definition at line 60 of file ActionCorrFunc.hpp.
◆ ActionCorrFunc()
OpenMD::ActionCorrFunc::ActionCorrFunc |
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SimInfo * | info, |
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const std::string & | filename, |
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const std::string & | sele1, |
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const std::string & | sele2 ) |
◆ calcCorrVal()
Mat3x3d OpenMD::ActionCorrFunc::calcCorrVal |
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int | frame1, |
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int | frame2 ) |
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protectedvirtual |
◆ computeProperty1()
void OpenMD::ActionCorrFunc::computeProperty1 |
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int | frame1 | ) |
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protectedvirtual |
◆ action_
std::vector<Mat3x3d> OpenMD::ActionCorrFunc::action_ |
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◆ forceMan_
◆ pressure_
◆ thermo_
Thermo* OpenMD::ActionCorrFunc::thermo_ |
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◆ time_
std::vector<RealType> OpenMD::ActionCorrFunc::time_ |
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protected |
The documentation for this class was generated from the following files: