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Gromacs
2026.0-dev-20251105-11eb1db
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#include <gromacs/nbnxm/pairsearch.h>
Collaboration diagram for gmx::PairsearchWork:Thread-local work struct, contains working data for Grid.
Public Attributes | |
| gmx_cache_protect_t | cp0 |
| Buffer to avoid cache pollution. | |
| std::vector< int > | sortBuffer |
| Temporary buffer for sorting atoms within a grid column. | |
| std::vector< gmx_bitmask_t > | buffer_flags |
| Flags for force buffer access. | |
| int | ndistc |
| Number of distance checks for flop counting. | |
| std::unique_ptr< AtomPairlist > | nbl_fep |
| Temporary FEP list for load balancing. | |
| nbnxn_cycle_t | cycleCounter |
| Counter for thread-local cycles. | |
| gmx_cache_protect_t | cp1 |
| Buffer to avoid cache pollution. | |
1.8.5