Searched defs:rijy (Results 1 – 3 of 3) sorted by relevance
| /dports/science/gabedit/GabeditSrc251_300720/src/MolecularMechanics/ |
| H A D | MolecularMechanics.c | 1414 gdouble rijx, rijy, rijz, forceConstant, equilibriumDistance, term; in calculateGradientBondAmber() local
1488 gdouble rijx, rijy, rijz; in calculateGradientBendAmber() local
1812 gdouble rijx, rijy, rijz; in calculateGradientNonBondedAmber() local
1906 gdouble rijx, rijy, rijz; in calculateGradientHydrogenBondedAmber() local
1964 gdouble rijx, rijy, rijz; in calculateGradientPairWise() local
2197 gdouble rijx, rijy, rijz, forceConstant, equilibriumDistance, term; in calculateEnergyBondAmber() local
2334 gdouble rijx, rijy, rijz; in calculateEnergyfNonBondedAmber() local
2400 gdouble rijx, rijy, rijz; in calculateEnergyHydrogenBondedAmber() local
2458 gdouble rijx, rijy, rijz; in calculateEnergyPairWise() local
|
| /dports/science/gromacs/gromacs-2021.4/src/gromacs/mdlib/ |
| H A D | shake.cpp | 300 const real rijy = initial_displacements[ll][YY]; in cshake() local
396 const real rijy = rij[ll][YY]; in crattle() local
|
| /dports/science/lammps/lammps-stable_29Sep2021/src/INTEL/ |
| H A D | pair_airebo_intel.cpp | 871 flt_t rijx, flt_t rijy, flt_t rijz, flt_t rijmag, flt_t wij, flt_t VA, in frebo_pij()
|