Gromacs
2026.0-dev-20250116-fa3fd9d
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This is the complete list of members for gmx::VirtualSitesHandler::Impl, including all inherited members.
construct(ArrayRef< RVec > x, ArrayRef< RVec > v, const matrix box, VSiteOperation operation) const | gmx::VirtualSitesHandler::Impl | |
Impl(const gmx_mtop_t &mtop, gmx_domdec_t *domdec, PbcType pbcType, ArrayRef< const RangePartitioning > updateGroupingPerMoleculeType) | gmx::VirtualSitesHandler::Impl | |
numInterUpdategroupVirtualSites() const | gmx::VirtualSitesHandler::Impl | inline |
setVirtualSites(ArrayRef< const InteractionList > ilist, int numAtoms, int homenr, ArrayRef< const ParticleType > ptype) | gmx::VirtualSitesHandler::Impl | |
spreadForces(ArrayRef< const RVec > x, ArrayRef< RVec > f, VirialHandling virialHandling, ArrayRef< RVec > fshift, matrix virial, t_nrnb *nrnb, const matrix box, gmx_wallcycle *wcycle) | gmx::VirtualSitesHandler::Impl |