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42 #include "types/nbnxn_cuda_types_ext.h"
54 /*! Launch asynchronously the nonbonded force calculations.
55 * This consists of the following (async) steps launched:
57 * - upload shift vector;
59 * The local and non-local interaction calculations are launched in two
62 void nbnxn_cuda_launch_kernel(nbnxn_cuda_ptr_t cu_nb,
63 const nbnxn_atomdata_t *nbdata,
67 /*! Launch asynchronously the download of nonbonded forces from the GPU
68 * (and energies/shift forces if required).
70 void nbnxn_cuda_launch_cpyback(nbnxn_cuda_ptr_t cu_nb,
71 const nbnxn_atomdata_t *nbatom,
75 /*! Wait for the asynchronously launched nonbonded calculations and data
76 * transfers to finish.
78 void nbnxn_cuda_wait_gpu(nbnxn_cuda_ptr_t cu_nb,
79 const nbnxn_atomdata_t * nbatom,
81 real *e_lj, real *e_el,
82 rvec *fshift) FUNC_TERM
90 #endif /* NBNXN_CUDA_H */