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40 * This header has the sole purpose of generating kernels for the supported
41 * electrostatics types: cut-off, reaction-field, Ewald, and tabulated Ewald.
43 * The Ewald kernels have twin-range cut-off versions with rcoul != rvdw which
44 * require an extra distance check to enable PP-PME load balancing
45 * (otherwise, by default rcoul == rvdw).
47 * NOTE: No include fence as it is meant to be included multiple times.
50 /* Analytical plain cut-off kernels */
52 #define NB_KERNEL_FUNC_NAME(x,...) x##_cutoff##__VA_ARGS__
53 #include "nbnxn_cuda_kernel_legacy.cuh"
54 #include "nbnxn_cuda_kernel.cuh"
56 #undef NB_KERNEL_FUNC_NAME
58 /* Analytical reaction-field kernels */
60 #define NB_KERNEL_FUNC_NAME(x,...) x##_rf##__VA_ARGS__
61 #include "nbnxn_cuda_kernel_legacy.cuh"
62 #include "nbnxn_cuda_kernel.cuh"
64 #undef NB_KERNEL_FUNC_NAME
66 /* Analytical Ewald interaction kernels
67 * NOTE: no legacy kernels with analytical Ewald.
70 #define NB_KERNEL_FUNC_NAME(x,...) x##_ewald##__VA_ARGS__
71 #include "nbnxn_cuda_kernel.cuh"
73 #undef NB_KERNEL_FUNC_NAME
75 /* Analytical Ewald interaction kernels with twin-range cut-off
76 * NOTE: no legacy kernels with analytical Ewald.
79 #define VDW_CUTOFF_CHECK
80 #define NB_KERNEL_FUNC_NAME(x,...) x##_ewald_twin##__VA_ARGS__
81 #include "nbnxn_cuda_kernel.cuh"
83 #undef VDW_CUTOFF_CHECK
84 #undef NB_KERNEL_FUNC_NAME
86 /* Tabulated Ewald interaction kernels */
88 #define NB_KERNEL_FUNC_NAME(x,...) x##_ewald_tab##__VA_ARGS__
89 #include "nbnxn_cuda_kernel_legacy.cuh"
90 #include "nbnxn_cuda_kernel.cuh"
92 #undef NB_KERNEL_FUNC_NAME
94 /* Tabulated Ewald interaction kernels with twin-range cut-off */
96 #define VDW_CUTOFF_CHECK
97 #define NB_KERNEL_FUNC_NAME(x,...) x##_ewald_tab_twin##__VA_ARGS__
98 #include "nbnxn_cuda_kernel_legacy.cuh"
99 #include "nbnxn_cuda_kernel.cuh"
101 #undef VDW_CUTOFF_CHECK
102 #undef NB_KERNEL_FUNC_NAME