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Extended maximum residue number and number of temperatures.
[unres.git]
/
CMakeLists.txt
diff --git
a/CMakeLists.txt
b/CMakeLists.txt
index
699a92a
..
3022b58
100644
(file)
--- a/
CMakeLists.txt
+++ b/
CMakeLists.txt
@@
-144,6
+144,7
@@
find_package(MPI QUIET)
if (MPI_Fortran_FOUND)
message("MPI found")
FIX_DBL_INCLUDE(MPI_Fortran_INCLUDE_PATH)
if (MPI_Fortran_FOUND)
message("MPI found")
FIX_DBL_INCLUDE(MPI_Fortran_INCLUDE_PATH)
+ option(UNRES_SRUN "Use srun instead of mpiexec ?" OFF )
else()
message("MPI not found - disabling MPI compile flags ")
set ( UNRES_WITH_MPI "OFF")
else()
message("MPI not found - disabling MPI compile flags ")
set ( UNRES_WITH_MPI "OFF")