projects
/
unres4.git
/ blobdiff
commit
grep
author
committer
pickaxe
?
search:
re
summary
|
shortlog
|
log
|
commit
|
commitdiff
|
tree
raw
|
inline
| side by side
working cutoff
[unres4.git]
/
source
/
unres
/
CMakeLists.txt
diff --git
a/source/unres/CMakeLists.txt
b/source/unres/CMakeLists.txt
index
98ec447
..
3b6f103
100644
(file)
--- a/
source/unres/CMakeLists.txt
+++ b/
source/unres/CMakeLists.txt
@@
-46,7
+46,7
@@
set(UNRES_MD_SRC0
if(UNRES_NEWGRAD)
set(UNRES_MD_SRC0 ${UNRES_MD_SRC0}
if(UNRES_NEWGRAD)
set(UNRES_MD_SRC0 ${UNRES_MD_SRC0}
- fdisy.F90 fdiag.f90 machpd.f90
+ fdisy.F90 fdiag.F90 machpd.F90
quindibisectok.F90
quindet2ok.F90)
endif()
quindibisectok.F90
quindet2ok.F90)
endif()
@@
-70,9
+70,9
@@
set(UNRES_MD_SRC3
#================================================
if (Fortran_COMPILER_NAME STREQUAL "ifort")
set (CMAKE_Fortran_FLAGS_RELEASE " ")
#================================================
if (Fortran_COMPILER_NAME STREQUAL "ifort")
set (CMAKE_Fortran_FLAGS_RELEASE " ")
- set (CMAKE_Fortran_FLAGS_DEBUG "-O0 -g ")
+ set (CMAKE_Fortran_FLAGS_DEBUG "-O0 -g -traceback")
# set(FFLAGS0 "-fpp -c -O3 -ip " )
# set(FFLAGS0 "-fpp -c -O3 -ip " )
- set(FFLAGS0 "-O3 -ip -fpp -heap-arrays" )
+ set(FFLAGS0 "-O3 -ip -fpp -heap-arrays -mcmodel=medium" )
# set(FFLAGS0 "-O0 -CB -CA -g" )
set(FFLAGS1 "-fpp -c -O " )
set(FFLAGS2 "-fpp -c -g -CA -CB ")
# set(FFLAGS0 "-O0 -CB -CA -g" )
set(FFLAGS1 "-fpp -c -O " )
set(FFLAGS2 "-fpp -c -g -CA -CB ")
@@
-111,6
+111,10
@@
if(UNRES_MD_FF STREQUAL "GAB" )
elseif(UNRES_MD_FF STREQUAL "E0LL2Y")
# set preprocesor flags
set(CPPFLAGS "PROCOR -DUNRES -DISNAN -DSPLITELE -DLANG0" )
elseif(UNRES_MD_FF STREQUAL "E0LL2Y")
# set preprocesor flags
set(CPPFLAGS "PROCOR -DUNRES -DISNAN -DSPLITELE -DLANG0" )
+elseif(UNRES_MD_FF STREQUAL "NEWCORR")
+ # set preprocesor flags
+ set(CPPFLAGS "PROCOR -DUNRES -DISNAN -DSPLITELE -DLANG0 -DNEWCORR -DCORRCD" )
+
#=========================================
# Settings for 4P force field
#=========================================
# Settings for 4P force field