int ncg_home = 0;
/* Global atom group indices for the home and all non-home groups */
std::vector<int> globalAtomGroupIndices;
- /* The atom groups for the home and all non-home groups, todo: make private */
- gmx::RangePartitioning atomGrouping_;
- const gmx::RangePartitioning &atomGrouping() const
- {
- return atomGrouping_;
- }
- /* Local atom to local atom-group index, only used for checking bondeds */
- std::vector<int> localAtomGroupFromAtom;
/* Index from the local atoms to the global atoms, covers home and received zones */
std::vector<int> globalAtomIndices;