src/gromacs/mdlib/nbnxn_kernels/simd_4xn/nbnxn_kernel_ElecEw_VdwLJFSw_F_4xn.c

   1 /*
   2  * This file is part of the GROMACS molecular simulation package.
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   5  * Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl,
   6  * and including many others, as listed in the AUTHORS file in the
   7  * top-level source directory and at http://www.gromacs.org.
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  35 /*
  36  * Note: this file was generated by the Verlet kernel generator for
  37  * kernel type 4xn.
  38  */
  39
  40 /* Some target architectures compile kernels for only some NBNxN
  41  * kernel flavours, but the code is generated before the target
  42  * architecture is known. So compilation is conditional upon
  43  * GMX_NBNXN_SIMD_4XN, so that this file reduces to a stub
  44  * function definition when the kernel will never be called.
  45  */
  46 #include "gmxpre.h"
  47
  48 #include "gromacs/mdlib/nbnxn_simd.h"
  49
  50 #define GMX_SIMD_J_UNROLL_SIZE 1
  51 #include "gromacs/mdlib/nbnxn_kernels/simd_4xn/nbnxn_kernel_simd_4xn.h"
  52
  53 #define CALC_COUL_EWALD
  54 #define LJ_FORCE_SWITCH
  55 /* Use full LJ combination matrix */
  56 /* Will not calculate energies */
  57
  58 #ifdef GMX_NBNXN_SIMD_4XN
  59 #include "gromacs/mdlib/nbnxn_kernels/simd_4xn/nbnxn_kernel_simd_4xn_common.h"
  60 #endif /* GMX_NBNXN_SIMD_4XN */
  61
  62 #ifdef CALC_ENERGIES
  63 void
  64 nbnxn_kernel_ElecEw_VdwLJFSw_F_4xn(const nbnxn_pairlist_t    gmx_unused *nbl,
  65                                    const nbnxn_atomdata_t    gmx_unused *nbat,
  66                                    const interaction_const_t gmx_unused *ic,
  67                                    rvec                      gmx_unused *shift_vec,
  68                                    real                      gmx_unused *f,
  69                                    real                      gmx_unused *fshift,
  70                                    real                      gmx_unused *Vvdw,
  71                                    real                      gmx_unused *Vc)
  72 #else /* CALC_ENERGIES */
  73 void
  74 nbnxn_kernel_ElecEw_VdwLJFSw_F_4xn(const nbnxn_pairlist_t    gmx_unused *nbl,
  75                                    const nbnxn_atomdata_t    gmx_unused *nbat,
  76                                    const interaction_const_t gmx_unused *ic,
  77                                    rvec                      gmx_unused *shift_vec,
  78                                    real                      gmx_unused *f,
  79                                    real                      gmx_unused *fshift)
  80 #endif /* CALC_ENERGIES */
  81 #ifdef GMX_NBNXN_SIMD_4XN
  82 #include "gromacs/mdlib/nbnxn_kernels/simd_4xn/nbnxn_kernel_simd_4xn_outer.h"
  83 #else /* GMX_NBNXN_SIMD_4XN */
  84 {
  85 /* No need to call gmx_incons() here, because the only function
  86  * that calls this one is also compiled conditionally. When
  87  * GMX_NBNXN_SIMD_4XN is not defined, it will call no kernel functions and
  88  * instead call gmx_incons().
  89  */
  90 }
  91 #endif /* GMX_NBNXN_SIMD_4XN */