src/gromacs/nbnxm/kernels_simd_4xm/kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_VgrpF.cpp

   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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  10  * modify it under the terms of the GNU Lesser General Public License
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  35 /*
  36  * Note: this file was generated by the Verlet kernel generator for
  37  * kernel type 4xm.
  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/mdtypes/interaction_const.h"
  49 #include "gromacs/nbnxm/nbnxm_simd.h"
  50
  51 #define GMX_SIMD_J_UNROLL_SIZE 1
  52 #include "gromacs/nbnxm/kernels_simd_4xm/kernels.h"
  53
  54 #define CALC_COUL_TAB
  55 #define VDW_CUTOFF_CHECK /* Use twin-range cut-off */
  56 #define LJ_CUT
  57 #define LJ_EWALD_GEOM
  58 /* Use full LJ combination matrix + geometric rule for the grid correction */
  59 #define CALC_ENERGIES
  60 #define ENERGY_GROUPS
  61
  62 #ifdef GMX_NBNXN_SIMD_4XN
  63 #include "gromacs/nbnxm/kernels_simd_4xm/kernel_common.h"
  64 #endif /* GMX_NBNXN_SIMD_4XN */
  65
  66 #ifdef CALC_ENERGIES
  67 void
  68 nbnxm_kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_VgrpF_4xm(const NbnxnPairlistCpu    gmx_unused *nbl,
  69                                                         const nbnxn_atomdata_t    gmx_unused *nbat,
  70                                                         const interaction_const_t gmx_unused *ic,
  71                                                         const rvec                gmx_unused *shift_vec,
  72                                                         nbnxn_atomdata_output_t   gmx_unused *out)
  73 #else /* CALC_ENERGIES */
  74 void
  75 nbnxm_kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_VgrpF_4xm(const NbnxnPairlistCpu    gmx_unused *nbl,
  76                                                         const nbnxn_atomdata_t    gmx_unused *nbat,
  77                                                         const interaction_const_t gmx_unused *ic,
  78                                                         const rvec                gmx_unused *shift_vec,
  79                                                         nbnxn_atomdata_output_t   gmx_unused *out)
  80 #endif /* CALC_ENERGIES */
  81 #ifdef GMX_NBNXN_SIMD_4XN
  82 #include "gromacs/nbnxm/kernels_simd_4xm/kernel_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 */