#================================
# Set source file lists
#================================
-set(UNRES_MDM_SRC0
+set(UNRES_MDMN_SRC0
add.f
arcos.f
banach.f
)
if (Fortran_COMPILER_NAME STREQUAL "ifort")
- set(UNRES_MDM_SRC0 ${UNRES_MDM_SRC0} prng.f )
+ set(UNRES_MDMN_SRC0 ${UNRES_MDMN_SRC0} prng.f )
elseif(Fortran_COMPILER_NAME STREQUAL "mpif90")
- set(UNRES_MDM_SRC0 ${UNRES_MDM_SRC0} prng.f )
+ set(UNRES_MDMN_SRC0 ${UNRES_MDMN_SRC0} prng.f )
else()
- set(UNRES_MDM_SRC0 ${UNRES_MDM_SRC0} prng_32.F )
+ set(UNRES_MDMN_SRC0 ${UNRES_MDMN_SRC0} prng_32.F )
endif (Fortran_COMPILER_NAME STREQUAL "ifort")
-set(UNRES_MDM_SRC2 eigen.f)
-set(UNRES_MDM_SRC3 energy_p_new_barrier.F energy_p_new-sep_barrier.F gradient_p.F )
+set(UNRES_MDMN_SRC2 eigen.f)
+set(UNRES_MDMN_SRC3 energy_p_new_barrier.F energy_p_new-sep_barrier.F gradient_p.F )
-set(UNRES_MDM_PP_SRC
+set(UNRES_MDMN_PP_SRC
bank.F
cartder.F
chainbuild.F
if(NOT Fortran_COMPILER_NAME STREQUAL "ifort")
- set(UNRES_MDM_PP_SRC "${UNRES_MDM_PP_SRC} prng_32.F")
+ set(UNRES_MDMN_PP_SRC "${UNRES_MDMN_PP_SRC} prng_32.F")
endif(NOT Fortran_COMPILER_NAME STREQUAL "ifort")
set(FFLAGS3 "${FFLAGS3} -I${MPIF_INCLUDE_DIRECTORIES}")
endif(UNRES_WITH_MPI)
-set_property(SOURCE ${UNRES_MDM_SRC0} APPEND PROPERTY COMPILE_FLAGS ${FFLAGS0} )
+set_property(SOURCE ${UNRES_MDMN_SRC0} APPEND PROPERTY COMPILE_FLAGS ${FFLAGS0} )
set_property(SOURCE ${UNRES_MD_SRC1} PROPERTY COMPILE_FLAGS ${FFLAGS1} )
set_property(SOURCE ${UNRES_MD_SRC2} PROPERTY COMPILE_FLAGS ${FFLAGS2} )
-set_property(SOURCE ${UNRES_MDM_SRC3} PROPERTY COMPILE_FLAGS ${FFLAGS3} )
+set_property(SOURCE ${UNRES_MDMN_SRC3} PROPERTY COMPILE_FLAGS ${FFLAGS3} )
#=========================================
# Settings for GAB force field
# Apply preprocesor flags to *.F files
-set_property(SOURCE ${UNRES_MDM_PP_SRC} PROPERTY COMPILE_DEFINITIONS ${CPPFLAGS} )
+set_property(SOURCE ${UNRES_MDMN_PP_SRC} PROPERTY COMPILE_DEFINITIONS ${CPPFLAGS} )
# Apply preprocesor flags to proc_proc.c
set_property(SOURCE proc_proc.c PROPERTY COMPILE_DEFINITIONS "SGI" )
set_property(SOURCE ${CMAKE_CURRENT_BINARY_DIR}/cinfo.f PROPERTY COMPILE_FLAGS "${FFLAGS0} -I${CMAKE_CURRENT_SOURCE_DIR}")
#=========================================
-# Set full unres MD-M sources
+# Set full unres MD-MN sources
#=========================================
-set(UNRES_MDM_SRCS ${UNRES_MDM_SRC0} ${UNRES_MDM_SRC2} ${UNRES_MDM_SRC3} ${CMAKE_CURRENT_BINARY_DIR}/cinfo.f proc_proc.c )
+set(UNRES_MDMN_SRCS ${UNRES_MDMN_SRC0} ${UNRES_MDMN_SRC2} ${UNRES_MDMN_SRC3} ${CMAKE_CURRENT_BINARY_DIR}/cinfo.f proc_proc.c )
#=========================================
# Build the binary
#=========================================
-add_executable(UNRES_BIN-MD-M ${UNRES_MDM_SRCS} )
-set_target_properties(UNRES_BIN-MD-M PROPERTIES OUTPUT_NAME ${UNRES_BIN})
+add_executable(UNRES_BIN-MD-MN ${UNRES_MDMN_SRCS} )
+set_target_properties(UNRES_BIN-MD-MN PROPERTIES OUTPUT_NAME ${UNRES_BIN})
#set_property(TARGET ${UNRES_BIN} PROPERTY RUNTIME_OUTPUT_DIRECTORY ${CMAKE_BINARY_DIR}/bin/unres/MD )
#add_dependencies (${UNRES_BIN} ${UNRES_XDRFLIB})
#=========================================
# link MPI library (libmpich.a)
if(UNRES_WITH_MPI)
- target_link_libraries( UNRES_BIN-MD-M ${MPIF_LIBRARIES} )
+ target_link_libraries( UNRES_BIN-MD-MN ${MPIF_LIBRARIES} )
endif(UNRES_WITH_MPI)
# link libxdrf.a
#message("UNRES_XDRFLIB=${UNRES_XDRFLIB}")
-target_link_libraries( UNRES_BIN-MD-M xdrf )
+target_link_libraries( UNRES_BIN-MD-MN xdrf )
#=========================================
# TESTS
#================================
# Set source file lists
#================================
-set(UNRES_WHAM_SRC0
+set(UNRES_WHAM_SRCMN0
wham_multparm.F
bxread.F
xread.F
mysort.f
)
-set(UNRES_WHAM_PP_SRC
+set(UNRES_WHAM_PP_SRCMN
bxread.F
chainbuild.F
conf_compar.F
set(FFLAGS0 "${FFLAGS0} -I${MPIF_INCLUDE_DIRECTORIES}")
endif(UNRES_WITH_MPI)
-set_property(SOURCE ${UNRES_WHAM_SRC0} PROPERTY COMPILE_FLAGS ${FFLAGS0} )
+set_property(SOURCE ${UNRES_WHAM_SRCMN0} PROPERTY COMPILE_FLAGS ${FFLAGS0} )
#=========================================
# WHAM preprocesor flags
#=========================================
# Apply preprocesor flags to *.F files
#=========================================
-set_property(SOURCE ${UNRES_WHAM_PP_SRC} PROPERTY COMPILE_DEFINITIONS ${CPPFLAGS} )
+set_property(SOURCE ${UNRES_WHAM_PP_SRCMN} PROPERTY COMPILE_DEFINITIONS ${CPPFLAGS} )
#========================================
# Setting binary name
#========================================
-set(UNRES_WHAM_BIN "wham_${Fortran_COMPILER_NAME}.exe")
+set(UNRES_WHAM_BINMN "wham_${Fortran_COMPILER_NAME}.exe")
#=========================================
# cinfo.f workaround for CMake
#=========================================
# Set full unres CSA sources
#=========================================
-set(UNRES_WHAM_SRCS ${UNRES_WHAM_SRC0} ${CMAKE_CURRENT_BINARY_DIR}/cinfo.f proc_proc.c)
+set(UNRES_WHAM_SRCMNS ${UNRES_WHAM_SRCMN0} ${CMAKE_CURRENT_BINARY_DIR}/cinfo.f proc_proc.c)
#=========================================
# Build the binary
#=========================================
-add_executable(UNRES_WHAM_BIN ${UNRES_WHAM_SRCS} )
-set_target_properties(UNRES_WHAM_BIN PROPERTIES OUTPUT_NAME ${UNRES_WHAM_BIN})
+add_executable(UNRES_WHAM_BINMN ${UNRES_WHAM_SRCMNS} )
+set_target_properties(UNRES_WHAM_BINMN PROPERTIES OUTPUT_NAME ${UNRES_WHAM_BINMN})
#set_property(TARGET ${UNRES_BIN} PROPERTY RUNTIME_OUTPUT_DIRECTORY ${CMAKE_BINARY_DIR}/bin/unres/MD )
#add_dependencies (${UNRES_BIN} ${UNRES_XDRFLIB})
# Link libraries
#=========================================
# link MPI library (libmpich.a)
-target_link_libraries( UNRES_WHAM_BIN ${MPIF_LIBRARIES} )
+target_link_libraries( UNRES_WHAM_BINMN ${MPIF_LIBRARIES} )
# link libxdrf.a
-target_link_libraries( UNRES_WHAM_BIN xdrf )
+target_link_libraries( UNRES_WHAM_BINMN xdrf )
#=========================================
# TESTS