X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc%2FCMakeLists.txt;h=b58dda7075b78792aab371461a3abbfb52e7e358;hb=393df3072295fbcf1bd8aeb2a9a206c1e1dde94a;hp=5635fc7659400353376cb3c03a42b7117954d57f;hpb=40861d754229b6858ca997cebffbc084b5840e51;p=unres.git diff --git a/source/wham/src/CMakeLists.txt b/source/wham/src/CMakeLists.txt index 5635fc7..b58dda7 100644 --- a/source/wham/src/CMakeLists.txt +++ b/source/wham/src/CMakeLists.txt @@ -244,6 +244,15 @@ install(TARGETS UNRES_WHAM_BIN DESTINATION ${CMAKE_INSTALL_PREFIX}/wham) # TESTS #========================================= +# MESSAGE (STATUS "${MPI_Fortran_LIBRARIES}") + if ("${MPI_Fortran_LIBRARIES}" MATCHES "lam") + MESSAGE (STATUS "LAM MPI library detected") + set (boot_lam "-boot") + else() + set (boot_lam "") + endif() + + FILE(WRITE ${CMAKE_CURRENT_BINARY_DIR}/scripts/wham_mpi_E0LL2Y.sh "#!/bin/sh export POT=GB @@ -270,7 +279,7 @@ export SIDEP=$DD/contact.3.parm export SCRATCHDIR=. #----------------------------------------------------------------------------- echo CTEST_FULL_OUTPUT -mpiexec -np $2 $WHAM_BIN +mpiexec ${boot_lam} -np $2 $WHAM_BIN ./wham_check.sh $1 ")