X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;ds=sidebyside;f=source%2Fcluster%2Fwham%2Fsrc-HCD-5D%2FCMakeLists.txt;h=a9321743ac7b926b6421eed244ab57ea8ec3da48;hb=b6b1679cfe492bd5b73e03410f82917bd9c3aa7b;hp=29b4616e493de46b4890baedd6b32c1797cb6b37;hpb=fb31d9cf50bce06dbfae62c92c11f3e9c836f405;p=unres.git diff --git a/source/cluster/wham/src-HCD-5D/CMakeLists.txt b/source/cluster/wham/src-HCD-5D/CMakeLists.txt index 29b4616..a932174 100644 --- a/source/cluster/wham/src-HCD-5D/CMakeLists.txt +++ b/source/cluster/wham/src-HCD-5D/CMakeLists.txt @@ -112,16 +112,16 @@ set_property(SOURCE ${UNRES_CLUSTER_WHAM_M_SRC0} PROPERTY COMPILE_FLAGS ${FFLAGS #========================================= if(UNRES_MD_FF STREQUAL "GAB" ) # set preprocesor flags - set(CPPFLAGS "PROCOR -DSPLITELE -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DSCCORPDB" ) + set(CPPFLAGS "PROCOR -DSPLITELE -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DSCCORPDB -DFOURBODY" ) #========================================= # Settings for E0LL2Y force field #========================================= elseif(UNRES_MD_FF STREQUAL "E0LL2Y") # set preprocesor flags - set(CPPFLAGS "PROCOR -DSPLITELE -DSCCORPDB" ) + set(CPPFLAGS "PROCOR -DSPLITELE -DSCCORPDB -DFOURBODY" ) elseif(UNRES_MD_FF STREQUAL "4P") - set(CPPFLAGS "SPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DSCCORPDB" ) + set(CPPFLAGS "SPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DSCCORPDB -DFOURBODY" ) elseif(UNRES_MD_FF STREQUAL "NEWCORR") set(CPPFLAGS "PROCOR -DSPLITELE -DCORRCD -DNEWCORR" ) endif(UNRES_MD_FF STREQUAL "GAB") @@ -180,9 +180,9 @@ set_property(SOURCE proc_proc.c PROPERTY COMPILE_DEFINITIONS "LINUX -DPGI" ) # Setting binary name #======================================== if(UNRES_DFA) - set(UNRES_CLUSTER_WHAM_M_BIN "cluster_wham-mult_${Fortran_COMPILER_NAME}_MPI_${UNRES_MD_FF}_DFA.exe") + set(UNRES_CLUSTER_WHAM_M_BIN "cluster_wham-mult_${Fortran_COMPILER_NAME}_MPI_${UNRES_MD_FF}_HCD-5D_DFA.exe") else(UNRES_DFA) - set(UNRES_CLUSTER_WHAM_M_BIN "cluster_wham-mult_${Fortran_COMPILER_NAME}_MPI_${UNRES_MD_FF}.exe") + set(UNRES_CLUSTER_WHAM_M_BIN "cluster_wham-mult_${Fortran_COMPILER_NAME}_MPI_${UNRES_MD_FF}_HCD-5D.exe") endif(UNRES_DFA) #=========================================