# Build the binaries
#=========================================
add_executable(xdrf2pdb ${UNRES_XDRF_XDRF2PDB_SRC} )
+set_property(TARGET xdrf2pdb PROPERTY RUNTIME_OUTPUT_DIRECTORY ${CMAKE_BINARY_DIR}/bin )
target_link_libraries( xdrf2pdb xdrf )
add_executable(xdrf2pdb-m ${UNRES_XDRF_XDRF2PDB-M_SRC} )
+set_property(TARGET xdrf2pdb-m PROPERTY RUNTIME_OUTPUT_DIRECTORY ${CMAKE_BINARY_DIR}/bin )
target_link_libraries( xdrf2pdb-m xdrf )
add_executable(xdrf2x ${UNRES_XDRF_XDRF2X_SRC} )
+set_property(TARGET xdrf2x PROPERTY RUNTIME_OUTPUT_DIRECTORY ${CMAKE_BINARY_DIR}/bin )
target_link_libraries( xdrf2x xdrf )
add_executable(xdrf2ang ${UNRES_XDRF_XDRF2XANG_SRC} )
+set_property(TARGET xdrf2ang PROPERTY RUNTIME_OUTPUT_DIRECTORY ${CMAKE_BINARY_DIR}/bin )
target_link_libraries( xdrf2ang xdrf )
#=========================================
+# Install Path
+#=========================================
+install(TARGETS xdrf2pdb DESTINATION ${CMAKE_INSTALL_PREFIX}/xdrfpdb)
+install(TARGETS xdrf2pdb-m DESTINATION ${CMAKE_INSTALL_PREFIX}/xdrfpdb)
+install(TARGETS xdrf2x DESTINATION ${CMAKE_INSTALL_PREFIX}/xdrfpdb)
+install(TARGETS xdrf2ang DESTINATION ${CMAKE_INSTALL_PREFIX}/xdrfpdb)
+
+
+#=========================================
# TESTS
#=========================================
+ if (UNRES_SRUN)
+ set (SRUN "srun")
+ else()
+ set (SRUN "")
+ endif()
+
+
# Create files needed for tests
-
-file(WRITE ${CMAKE_CURRENT_BINARY_DIR}/ala10one.seq
-"XAAAAAAAAAAX"
-)
-file(WRITE ${CMAKE_CURRENT_BINARY_DIR}/ala10three.seq
-"D Ala Ala Ala Ala Ala Ala Ala Ala Ala Ala D "
-)
+file( COPY ${CMAKE_SOURCE_DIR}/ctest/ala10one.seq
+ DESTINATION ${CMAKE_CURRENT_BINARY_DIR} )
+
+file( COPY ${CMAKE_SOURCE_DIR}/ctest/ala10three.seq
+ DESTINATION ${CMAKE_CURRENT_BINARY_DIR} )
+
+file( COPY ${CMAKE_SOURCE_DIR}/ctest/1L2Yone.seq
+ DESTINATION ${CMAKE_CURRENT_BINARY_DIR} )
+
+file( COPY ${CMAKE_SOURCE_DIR}/ctest/1L2Ythree.seq
+ DESTINATION ${CMAKE_CURRENT_BINARY_DIR} )
file( COPY ${CMAKE_SOURCE_DIR}/ctest/ala10MD.cx
DESTINATION ${CMAKE_CURRENT_BINARY_DIR} )
+file( COPY ${CMAKE_SOURCE_DIR}/ctest/1L2Y_MREMD_MD000.cx
+ DESTINATION ${CMAKE_CURRENT_BINARY_DIR} )
+
# Test xdrf2pdb
-add_test(NAME XDRF2PDB-one COMMAND xdrf2pdb one ala10one.seq ala10MD.cx )
-add_test(NAME XDRF2PDB-three COMMAND xdrf2pdb three ala10three.seq ala10MD.cx )
+add_test(NAME XDRF2PDB-one COMMAND ${SRUN} ${CMAKE_BINARY_DIR}/bin/xdrf2pdb one ala10one.seq ala10MD.cx )
+add_test(NAME XDRF2PDB-three COMMAND ${SRUN} ${CMAKE_BINARY_DIR}/bin/xdrf2pdb three ala10three.seq ala10MD.cx )
+
+# Test xdrf2pdb-m
+add_test(NAME XDRF2PDB-M-one COMMAND ${SRUN} ${CMAKE_BINARY_DIR}/bin/xdrf2pdb-m one 1L2Yone.seq 1L2Y_MREMD_MD000.cx 32 30 )
+add_test(NAME XDRF2PDB-M-three COMMAND ${SRUN} ${CMAKE_BINARY_DIR}/bin/xdrf2pdb-m three 1L2Ythree.seq 1L2Y_MREMD_MD000.cx 32 30 )
# Test xdrf2ang
-add_test(NAME XDRF2ANG-one COMMAND xdrf2ang one ala10one.seq ala10MD.cx )
-add_test(NAME XDRF2ANG-three COMMAND xdrf2ang three ala10three.seq ala10MD.cx )
+add_test(NAME XDRF2ANG-one COMMAND ${SRUN} ${CMAKE_BINARY_DIR}/bin/xdrf2ang one ala10one.seq ala10MD.cx )
+add_test(NAME XDRF2ANG-three COMMAND ${SRUN} ${CMAKE_BINARY_DIR}/bin/xdrf2ang three ala10three.seq ala10MD.cx )