NAMD
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This is the complete list of members for LjPmeCompute, including all inherited members.
computeLJpotential(const double &alphaLJ, const double &cutoff, const Lattice &lattice, double virialNonbonded[][3], double virialSlow[][3], double &energyNonbond, double &energySlow, bool doEnergy, bool doSlow) | LjPmeCompute | |
computeNonbonded(const double &alphaLJ, const double &cutoff, const Lattice &lattice, double virialNonbonded[][3], double virialSlow[][3], double &energyNonbond, double &energySlow) | LjPmeCompute | |
initialize(const double *pmeCoord, const double *parameter, const double *parameter14, const int *type, double *forceNonbond, double *forceSlow, const int &ljTableDim, const int &nAtoms) | LjPmeCompute | |
LjPmeCompute() | LjPmeCompute | inline |
~LjPmeCompute() | LjPmeCompute | inline |