/* * This file is part of the GROMACS molecular simulation package. * * Copyright (c) 2012,2013,2014, by the GROMACS development team, led by * Mark Abraham, David van der Spoel, Berk Hess, and Erik Lindahl, * and including many others, as listed in the AUTHORS file in the * top-level source directory and at http://www.gromacs.org. * * GROMACS is free software; you can redistribute it and/or * modify it under the terms of the GNU Lesser General Public License * as published by the Free Software Foundation; either version 2.1 * of the License, or (at your option) any later version. * * GROMACS is distributed in the hope that it will be useful, * but WITHOUT ANY WARRANTY; without even the implied warranty of * MERCHANTABILITY or FITNESS FOR A PARTICULAR PURPOSE. See the GNU * Lesser General Public License for more details. * * You should have received a copy of the GNU Lesser General Public * License along with GROMACS; if not, see * http://www.gnu.org/licenses, or write to the Free Software Foundation, * Inc., 51 Franklin Street, Fifth Floor, Boston, MA 02110-1301 USA. * * If you want to redistribute modifications to GROMACS, please * consider that scientific software is very special. Version * control is crucial - bugs must be traceable. We will be happy to * consider code for inclusion in the official distribution, but * derived work must not be called official GROMACS. Details are found * in the README & COPYING files - if they are missing, get the * official version at http://www.gromacs.org. * * To help us fund GROMACS development, we humbly ask that you cite * the research papers on the package. Check out http://www.gromacs.org. */ /*! \internal \file * This header has the sole purpose of generating kernels for the supported * electrostatics types: cut-off, reaction-field, Ewald, and tabulated Ewald. * * The Ewald kernels have twin-range cut-off versions with rcoul != rvdw which * require an extra distance check to enable PP-PME load balancing * (otherwise, by default rcoul == rvdw). * * NOTE: No include fence as it is meant to be included multiple times. */ /* Analytical plain cut-off kernels */ #define EL_CUTOFF #define NB_KERNEL_FUNC_NAME(x, ...) x ## _cutoff ## __VA_ARGS__ #include "nbnxn_cuda_kernel.cuh" #undef EL_CUTOFF #undef NB_KERNEL_FUNC_NAME /* Analytical reaction-field kernels */ #define EL_RF #define NB_KERNEL_FUNC_NAME(x, ...) x ## _rf ## __VA_ARGS__ #include "nbnxn_cuda_kernel.cuh" #undef EL_RF #undef NB_KERNEL_FUNC_NAME /* Analytical Ewald interaction kernels */ #define EL_EWALD_ANA #define NB_KERNEL_FUNC_NAME(x, ...) x ## _ewald ## __VA_ARGS__ #include "nbnxn_cuda_kernel.cuh" #undef EL_EWALD_ANA #undef NB_KERNEL_FUNC_NAME /* Analytical Ewald interaction kernels with twin-range cut-off */ #define EL_EWALD_ANA #define VDW_CUTOFF_CHECK #define NB_KERNEL_FUNC_NAME(x, ...) x ## _ewald_twin ## __VA_ARGS__ #include "nbnxn_cuda_kernel.cuh" #undef EL_EWALD_ANA #undef VDW_CUTOFF_CHECK #undef NB_KERNEL_FUNC_NAME /* Tabulated Ewald interaction kernels */ #define EL_EWALD_TAB #define NB_KERNEL_FUNC_NAME(x, ...) x ## _ewald_tab ## __VA_ARGS__ #include "nbnxn_cuda_kernel.cuh" #undef EL_EWALD_TAB #undef NB_KERNEL_FUNC_NAME /* Tabulated Ewald interaction kernels with twin-range cut-off */ #define EL_EWALD_TAB #define VDW_CUTOFF_CHECK #define NB_KERNEL_FUNC_NAME(x, ...) x ## _ewald_tab_twin ## __VA_ARGS__ #include "nbnxn_cuda_kernel.cuh" #undef EL_EWALD_TAB #undef VDW_CUTOFF_CHECK #undef NB_KERNEL_FUNC_NAME