X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2FCMakeLists.txt;h=803755a79dfc649e91ef0b881096a436615812d4;hb=bc23440fbe68672d430f71f22f46b11265f003db;hp=dc019747c49d948041ab896e2ed5f589d3ddbd0b;hpb=df2469d9ac903d93889867f4e50e9bf6c428c1c6;p=unres4.git diff --git a/source/wham/CMakeLists.txt b/source/wham/CMakeLists.txt index dc01974..803755a 100644 --- a/source/wham/CMakeLists.txt +++ b/source/wham/CMakeLists.txt @@ -51,7 +51,7 @@ set(UNRES_WHAM_SRC0 #================================================ if (Fortran_COMPILER_NAME STREQUAL "ifort") set (CMAKE_Fortran_FLAGS_RELEASE " -CB -g") - set (CMAKE_Fortran_FLAGS_DEBUG "-O0 -g ") + set (CMAKE_Fortran_FLAGS_DEBUG "-O0 -g -traceback") set(FFLAGS0 "-fpp -mcmodel=medium -shared-intel " ) elseif (Fortran_COMPILER_NAME STREQUAL "gfortran") set(FFLAGS0 "-fpp -std=legacy -mcmodel=medium -g ") @@ -86,6 +86,9 @@ if(UNRES_MD_FF STREQUAL "GAB" ) elseif(UNRES_MD_FF STREQUAL "E0LL2Y") # set preprocesor flags set(CPPFLAGS "PROCOR -DSPLITELE -DSCCORPDB" ) +elseif(UNRES_MD_FF STREQUAL "NEWCORR") + # set preprocesor flags + set(CPPFLAGS "PROCOR -DUNRES -DISNAN -DSPLITELE -DLANG0 -DNEWCORR -DCORRCD" ) elseif(UNRES_MD_FF STREQUAL "4P") set(CPPFLAGS "SPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DSCCORPDB" ) endif(UNRES_MD_FF STREQUAL "GAB")