Gromacs
2024.3
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This is the complete list of members for gmx::EnergyTerm, including all inherited members.
addFrame(double time, int64_t step, int numIntermediateStepsSum, double energySumOverNumSteps, double energyVarianceOverNumSteps, double energyAtTime) | gmx::EnergyTerm | |
average() const | gmx::EnergyTerm | inline |
begin() const | gmx::EnergyTerm | inline |
end() const | gmx::EnergyTerm | inline |
EnergyTerm(unsigned int indexWithinEnergyFile, bool bStoreData, const std::string &energyTerm, const std::string &energyUnit) | gmx::EnergyTerm | |
errorEstimate(unsigned int numBlocks) const | gmx::EnergyTerm | |
fileIndex() const | gmx::EnergyTerm | inline |
findFrame(int64_t frameIndex) const | gmx::EnergyTerm | |
name() const | gmx::EnergyTerm | inline |
numFrames() const | gmx::EnergyTerm | inline |
numSteps() const | gmx::EnergyTerm | inline |
setStoreData(bool bStoreData) | gmx::EnergyTerm | inline |
slopeOfLinearFit() const | gmx::EnergyTerm | |
standardDeviation() const | gmx::EnergyTerm | inline |
stepBegin() const | gmx::EnergyTerm | inline |
stepEnd() const | gmx::EnergyTerm | inline |
storeData() const | gmx::EnergyTerm | inline |
termIsEnergy() const | gmx::EnergyTerm | inline |
timeBegin() const | gmx::EnergyTerm | inline |
timeEnd() const | gmx::EnergyTerm | inline |
timeSpan() const | gmx::EnergyTerm | inline |
unit() const | gmx::EnergyTerm | inline |