Implemented LJ-PME nbnxn kernels

[alexxy/gromacs.git] / src / gromacs / mdlib / nbnxn_kernels / simd_2xnn / nbnxn_kernel_simd_2xnn.h

diff --git a/src/gromacs/mdlib/nbnxn_kernels/simd_2xnn/nbnxn_kernel_simd_2xnn.h b/src/gromacs/mdlib/nbnxn_kernels/simd_2xnn/nbnxn_kernel_simd_2xnn.h
index 9b84f84909a72343a9ff1f41c3170430d00820ef..58f1e768e01a4f9df9ac0412b1a7d6329016af3a 100644 (file)
--- a/src/gromacs/mdlib/nbnxn_kernels/simd_2xnn/nbnxn_kernel_simd_2xnn.h
+++ b/src/gromacs/mdlib/nbnxn_kernels/simd_2xnn/nbnxn_kernel_simd_2xnn.h
@@ -88,78 +88,93 @@ nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJCombLB_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJ_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJFSw_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJPSw_VgrpF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJEwCombGeom_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJCombGeom_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJCombLB_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJ_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJFSw_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJPSw_VgrpF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJEwCombGeom_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombGeom_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombLB_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJ_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJFSw_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJPSw_VgrpF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJCombGeom_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJCombLB_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJ_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJFSw_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJPSw_VgrpF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJEwCombGeom_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJCombGeom_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJCombLB_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJ_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJFSw_VgrpF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJPSw_VgrpF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJEwCombGeom_VgrpF_2xnn;
 
 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJCombLB_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJ_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJFSw_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJPSw_VF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecRF_VdwLJEwCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJCombLB_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJ_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJFSw_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJPSw_VF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecQSTab_VdwLJEwCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombLB_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJ_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJFSw_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJPSw_VF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJCombLB_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJ_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJFSw_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJPSw_VF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecEw_VdwLJEwCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJCombGeom_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJCombLB_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJ_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJFSw_VF_2xnn;
 nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJPSw_VF_2xnn;
+nbk_func_ener         nbnxn_kernel_ElecEwTwinCut_VdwLJEwCombGeom_VF_2xnn;
 
 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJCombLB_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJ_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJFSw_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJPSw_F_2xnn;
+nbk_func_noener       nbnxn_kernel_ElecRF_VdwLJEwCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJCombLB_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJ_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJFSw_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJPSw_F_2xnn;
+nbk_func_noener       nbnxn_kernel_ElecQSTab_VdwLJEwCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJCombLB_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJ_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJFSw_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJPSw_F_2xnn;
+nbk_func_noener       nbnxn_kernel_ElecQSTabTwinCut_VdwLJEwCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJCombLB_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJ_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJFSw_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJPSw_F_2xnn;
+nbk_func_noener       nbnxn_kernel_ElecEw_VdwLJEwCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJCombGeom_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJCombLB_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJ_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJFSw_F_2xnn;
 nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJPSw_F_2xnn;
+nbk_func_noener       nbnxn_kernel_ElecEwTwinCut_VdwLJEwCombGeom_F_2xnn;