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Merge branch 'devel' into AFM
[unres.git]
/
source
/
unres
/
src_MD-M
/
CMakeLists.txt
diff --git
a/source/unres/src_MD-M/CMakeLists.txt
b/source/unres/src_MD-M/CMakeLists.txt
index
6b1b37e
..
486a344
100644
(file)
--- a/
source/unres/src_MD-M/CMakeLists.txt
+++ b/
source/unres/src_MD-M/CMakeLists.txt
@@
-81,6
+81,7
@@
set(UNRES_MDM_SRC0
sc_move.F
shift.F
sort.f
sc_move.F
shift.F
sort.f
+ ssMD.F
stochfric.F
sumsld.f
surfatom.f
stochfric.F
sumsld.f
surfatom.f
@@
-89,7
+90,6
@@
set(UNRES_MDM_SRC0
timing.F
together.F
unres.F
timing.F
together.F
unres.F
- ssMD.F
)
set(UNRES_MDM_SRC3 energy_p_new_barrier.F energy_p_new-sep_barrier.F gradient_p.F )
)
set(UNRES_MDM_SRC3 energy_p_new_barrier.F energy_p_new-sep_barrier.F gradient_p.F )
@@
-142,6
+142,7
@@
set(UNRES_MDM_PP_SRC
rmsd.F
sc_move.F
shift.F
rmsd.F
sc_move.F
shift.F
+ ssMD.F
stochfric.F
sumsld.f
test.F
stochfric.F
sumsld.f
test.F
@@
-192,7
+193,7
@@
set_property(SOURCE ${UNRES_MDM_SRC3} PROPERTY COMPILE_FLAGS ${FFLAGS3} )
#=========================================
if(UNRES_MD_FF STREQUAL "GAB" )
# set preprocesor flags
#=========================================
if(UNRES_MD_FF STREQUAL "GAB" )
# set preprocesor flags
- set(CPPFLAGS "PROCOR -DUNRES -DISNAN -DSPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DSCCORPDB" )
+ set(CPPFLAGS "PROCOR -DUNRES -DISNAN -DSPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DSCCORPDB -DTIMING -DTIMING_ENE" )
#=========================================
# Settings for E0LL2Y force field
#=========================================
# Settings for E0LL2Y force field
@@
-324,7
+325,7
@@
target_link_libraries( UNRES_BIN-MD-M xdrf )
#=========================================
# Install Path
#=========================================
#=========================================
# Install Path
#=========================================
-install(TARGETS UNRES_BIN-MD-M DESTINATION ${CMAKE_INSTALL_PREFIX})
+install(TARGETS UNRES_BIN-MD-M DESTINATION ${CMAKE_INSTALL_PREFIX}/unres/MD)
#=========================================
# TESTS
#=========================================
# TESTS