src/gromacs/mdlib/nbnxn_kernels/simd_2xnn/nbnxn_kernel_simd_2xnn.h

   1 /*
   2  * This file is part of the GROMACS molecular simulation package.
   3  *
   4  * Copyright (c) 2012,2013,2014, by the GROMACS development team, led by
   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.
   8  *
   9  * GROMACS is free software; you can redistribute it and/or
  10  * modify it under the terms of the GNU Lesser General Public License
  11  * as published by the Free Software Foundation; either version 2.1
  12  * of the License, or (at your option) any later version.
  13  *
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  16  * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE.  See the GNU
  17  * Lesser General Public License for more details.
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  34  */
  35 /*
  36  * Note: this file was generated by the Verlet kernel generator for
  37  * kernel type 2xnn.
  38  */
  39
  40 #include "gromacs/legacyheaders/typedefs.h"
  41 #include "gromacs/mdlib/nbnxn_pairlist.h"
  42 #include "gromacs/mdlib/nbnxn_simd.h"
  43
  44 #ifdef __cplusplus
  45 extern "C" {
  46 #endif
  47 #if 0
  48 }
  49 #endif
  50
  51 /*! \brief Run-time dispatcher for nbnxn kernel functions. */
  52 void
  53 nbnxn_kernel_simd_2xnn(nbnxn_pairlist_set_t       *nbl_list,
  54                        const nbnxn_atomdata_t     *nbat,
  55                        const interaction_const_t  *ic,
  56                        int                         ewald_excl,
  57                        rvec                       *shift_vec,
  58                        int                         force_flags,
  59                        int                         clearF,
  60                        real                       *fshift,
  61                        real                       *Vc,
  62                        real                       *Vvdw);
  63
  64 /* Need an #include guard so that sim_util.c can include all
  65  * such files. */
  66 #ifndef _nbnxn_kernel_simd_include_h
  67 #define _nbnxn_kernel_simd_include_h
  68 /*! \brief Typedefs for declaring kernel functions. */
  69 typedef void (nbk_func_ener)(const nbnxn_pairlist_t     *nbl,
  70                              const nbnxn_atomdata_t     *nbat,
  71                              const interaction_const_t  *ic,
  72                              rvec                       *shift_vec,
  73                              real                       *f,
  74                              real                       *fshift,
  75                              real                       *Vvdw,
  76                              real                       *Vc);
  77 typedef nbk_func_ener *p_nbk_func_ener;
  78
  79 typedef void (nbk_func_noener)(const nbnxn_pairlist_t     *nbl,
  80                                const nbnxn_atomdata_t     *nbat,
  81                                const interaction_const_t  *ic,
  82                                rvec                       *shift_vec,
  83                                real                       *f,
  84                                real                       *fshift);
  85 typedef nbk_func_noener *p_nbk_func_noener;
  86 #endif
  87
  88 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJCombGeom_VgrpF_2xnn;
  89 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJCombLB_VgrpF_2xnn;
  90 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJ_VgrpF_2xnn;
  91 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJFSw_VgrpF_2xnn;
  92 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJPSw_VgrpF_2xnn;
  93 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJEwCombGeom_VgrpF_2xnn;
  94 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJCombGeom_VgrpF_2xnn;
  95 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJCombLB_VgrpF_2xnn;
  96 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJ_VgrpF_2xnn;
  97 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJFSw_VgrpF_2xnn;
  98 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJPSw_VgrpF_2xnn;
  99 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJEwCombGeom_VgrpF_2xnn;
 100 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombGeom_VgrpF_2xnn;
 101 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombLB_VgrpF_2xnn;
 102 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJ_VgrpF_2xnn;
 103 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJFSw_VgrpF_2xnn;
 104 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJPSw_VgrpF_2xnn;
 105 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_VgrpF_2xnn;
 106 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJCombGeom_VgrpF_2xnn;
 107 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJCombLB_VgrpF_2xnn;
 108 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJ_VgrpF_2xnn;
 109 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJFSw_VgrpF_2xnn;
 110 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJPSw_VgrpF_2xnn;
 111 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJEwCombGeom_VgrpF_2xnn;
 112 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJCombGeom_VgrpF_2xnn;
 113 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJCombLB_VgrpF_2xnn;
 114 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJ_VgrpF_2xnn;
 115 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJFSw_VgrpF_2xnn;
 116 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJPSw_VgrpF_2xnn;
 117 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJEwCombGeom_VgrpF_2xnn;
 118
 119 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJCombGeom_VF_2xnn;
 120 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJCombLB_VF_2xnn;
 121 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJ_VF_2xnn;
 122 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJFSw_VF_2xnn;
 123 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJPSw_VF_2xnn;
 124 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJEwCombGeom_VF_2xnn;
 125 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJCombGeom_VF_2xnn;
 126 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJCombLB_VF_2xnn;
 127 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJ_VF_2xnn;
 128 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJFSw_VF_2xnn;
 129 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJPSw_VF_2xnn;
 130 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJEwCombGeom_VF_2xnn;
 131 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombGeom_VF_2xnn;
 132 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombLB_VF_2xnn;
 133 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJ_VF_2xnn;
 134 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJFSw_VF_2xnn;
 135 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJPSw_VF_2xnn;
 136 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_VF_2xnn;
 137 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJCombGeom_VF_2xnn;
 138 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJCombLB_VF_2xnn;
 139 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJ_VF_2xnn;
 140 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJFSw_VF_2xnn;
 141 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJPSw_VF_2xnn;
 142 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJEwCombGeom_VF_2xnn;
 143 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJCombGeom_VF_2xnn;
 144 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJCombLB_VF_2xnn;
 145 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJ_VF_2xnn;
 146 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJFSw_VF_2xnn;
 147 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJPSw_VF_2xnn;
 148 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJEwCombGeom_VF_2xnn;
 149
 150 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJCombGeom_F_2xnn;
 151 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJCombLB_F_2xnn;
 152 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJ_F_2xnn;
 153 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJFSw_F_2xnn;
 154 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJPSw_F_2xnn;
 155 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJEwCombGeom_F_2xnn;
 156 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJCombGeom_F_2xnn;
 157 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJCombLB_F_2xnn;
 158 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJ_F_2xnn;
 159 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJFSw_F_2xnn;
 160 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJPSw_F_2xnn;
 161 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJEwCombGeom_F_2xnn;
 162 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombGeom_F_2xnn;
 163 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombLB_F_2xnn;
 164 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJ_F_2xnn;
 165 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJFSw_F_2xnn;
 166 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJPSw_F_2xnn;
 167 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_F_2xnn;
 168 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJCombGeom_F_2xnn;
 169 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJCombLB_F_2xnn;
 170 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJ_F_2xnn;
 171 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJFSw_F_2xnn;
 172 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJPSw_F_2xnn;
 173 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJEwCombGeom_F_2xnn;
 174 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJCombGeom_F_2xnn;
 175 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJCombLB_F_2xnn;
 176 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJ_F_2xnn;
 177 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJFSw_F_2xnn;
 178 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJPSw_F_2xnn;
 179 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJEwCombGeom_F_2xnn;
 180
 181
 182
 183 #if 0
 184 {
 185 #endif
 186 #ifdef __cplusplus
 187 }
 188 #endif