Gromacs
2025-dev-20240508-5d2129b
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Declare common functions for NBNXM GPU data management.
Functions | |
void | Nbnxm::gpu_init_platform_specific (NbnxmGpu *nb) |
Initializes the NBNXM GPU data structures. | |
void | Nbnxm::gpu_free_platform_specific (NbnxmGpu *nb) |
Releases the NBNXM GPU data structures. More... | |
void | Nbnxm::getExclusiveScanWorkingArraySize (size_t &scan_size, gpu_plist *d_plist, const DeviceStream &deviceStream) |
Calculates working memory required for exclusive sum, used in neighbour list sorting on GPU. | |