X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=CMakeLists.txt;h=2ee17e34d8c8ef7dfa2c49c3e9dd3219153c348e;hb=7eff63f792545f57fb86a8f2c0a2d37243d344a6;hp=8d0a5d0d548ba083c60defd70904273c74787bfb;hpb=62e2c1616bb6edf86824c466c6f82635ab6ad5e4;p=unres.git diff --git a/CMakeLists.txt b/CMakeLists.txt index 8d0a5d0..2ee17e3 100644 --- a/CMakeLists.txt +++ b/CMakeLists.txt @@ -144,6 +144,12 @@ find_package(MPI QUIET) if (MPI_Fortran_FOUND) message("MPI found") FIX_DBL_INCLUDE(MPI_Fortran_INCLUDE_PATH) + message(MPI_Fortran_INCLUDE_PATH) + message(${MPI_Fortran_INCLUDE_PATH}) + message(MPI_Fortran_LIBRARIES) + message(${MPI_Fortran_LIBRARIES}) + option(UNRES_SRUN "Use srun instead of mpiexec ?" OFF ) + option(UNRES_MPIRUN "Use mpirun instead of mpiexec ?" OFF ) else() message("MPI not found - disabling MPI compile flags ") set ( UNRES_WITH_MPI "OFF") @@ -184,7 +190,6 @@ if(UNRES_NA_MMCE) add_subdirectory(source/unres/src_MD) add_subdirectory(source/unres/src_MD-M) add_subdirectory(source/unres/src_CSA) - add_subdirectory(source/unres/src_CSA_DiL) add_subdirectory(source/cluster/wham/src) add_subdirectory(source/cluster/wham/src-M) endif (Fortran_COMPILER_NAME STREQUAL "ifort") @@ -197,14 +202,12 @@ if(UNRES_NA_MMCE) add_subdirectory(source/cluster/unres/src) add_subdirectory(source/xdrfpdb/src) add_subdirectory(source/xdrfpdb/src-M) - add_subdirectory(source/maxlik/src_CSA) else() add_subdirectory(source/unres/src_MD) if(UNRES_WITH_MPI) add_subdirectory(source/unres/src_MD-M) add_subdirectory(source/unres/src_CSA) - add_subdirectory(source/unres/src_CSA_DiL) add_subdirectory(source/wham/src) add_subdirectory(source/wham/src-M) add_subdirectory(source/cluster/wham/src) @@ -214,6 +217,5 @@ else() add_subdirectory(source/cluster/unres/src) add_subdirectory(source/xdrfpdb/src) add_subdirectory(source/xdrfpdb/src-M) - add_subdirectory(source/maxlik/src_CSA) endif(UNRES_NA_MMCE)