# # This file is part of the GROMACS molecular simulation package. # # Copyright (c) 2021, 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. # - Define function to check if underlying MPI is CUDA-aware # # GMX_TEST_CUDA_AWARE_MPI() # # GMX_TEST_CUDA_AWARE_MPI puts HAVE_CUDA_AWARE_MPI variable in cache # include(CheckCXXSourceCompiles) function(GMX_TEST_CUDA_AWARE_MPI) if (NOT DEFINED HAVE_CUDA_AWARE_MPI) MESSAGE(STATUS "Checking for CUDA_AWARE_MPI") list(JOIN MPI_COMPILE_FLAGS " " CMAKE_REQUIRED_FLAGS) set(CMAKE_REQUIRED_INCLUDES ${MPI_INCLUDE_PATH}) set(CMAKE_REQUIRED_LIBRARIES ${MPI_LIBRARIES}) # cannot use check_include_file here as mpi.h needs to be included # before mpi-ext.h for compilation, check_include_file doesn't support # this use-case check_cxx_source_compiles( "#include #include int main(void) { #if defined(MPIX_CUDA_AWARE_SUPPORT) && (MPIX_CUDA_AWARE_SUPPORT==1) return 0; #else #error MPI implementation is not CUDA-aware #endif }" HAVE_CUDA_AWARE_MPI) if(HAVE_CUDA_AWARE_MPI) MESSAGE(STATUS "Checking for CUDA_AWARE_MPI - yes") else() MESSAGE(STATUS "Checking for CUDA_AWARE_MPI - no") MESSAGE(WARNING "GROMACS cannot determine if underlying MPI is CUDA-aware, " "for better multi-GPU performance consider using a more recent CUDA-aware MPI.") endif() endif() endfunction() # Test if CUDA-aware MPI is supported gmx_test_cuda_aware_mpi()