X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-HCD-5D%2FCMakeLists.txt;h=42d52e95caaf5921e6d90507ff971d94d81b1084;hb=7baaf36efbc265e029ec93a4bb1adfadfd55d7bf;hp=f4ca64385557dfa896d7bef10e66626ecef3467b;hpb=b6b1679cfe492bd5b73e03410f82917bd9c3aa7b;p=unres.git

diff --git a/source/wham/src-HCD-5D/CMakeLists.txt b/source/wham/src-HCD-5D/CMakeLists.txt
index f4ca643..42d52e9 100644
--- a/source/wham/src-HCD-5D/CMakeLists.txt
+++ b/source/wham/src-HCD-5D/CMakeLists.txt
@@ -20,7 +20,6 @@ set(UNRES_WHAM_M_SRC0
 	readrtns.F
     	read_constr_homology.F
 	arcos.f
-	cartder.f
 	cartprint.f
 	chainbuild.F
 	geomout.F
@@ -49,7 +48,7 @@ set(UNRES_WHAM_M_SRC0
 	PMFprocess.F
 	oligomer.F
         readrtns_compar.F
-	readpdb.F
+	readpdb-mult.F
 	fitsq.f 
 	contact.f
 	elecont.f
@@ -68,6 +67,7 @@ set(UNRES_WHAM_M_SRC0
 	define_pairs.f
 	mysort.f
         ssMD.F
+        boxshift.f
 )
 
 set(UNRES_WHAM_M_PP_SRC
@@ -90,7 +90,7 @@ set(UNRES_WHAM_M_PP_SRC
 	PMFprocess.F
 	read_constr_homology.F
 	read_dist_constr.F
-	readpdb.F	
+	readpdb-mult.F	
 	read_ref_str.F
 	readrtns_compar.F
 	readrtns.F
@@ -165,6 +165,10 @@ set(CPPFLAGS "${CPPFLAGS} -DUNRES -DISNAN -DWHAM")
 if(UNRES_DFA)
  set(CPPFLAGS "${CPPFLAGS} -DDFA")
 endif(UNRES_DFA)
+
+if(UNRES_5D)
+ set(CPPFLAGS "${CPPFLAGS} -DFIVEDIAG" )
+endif()
  
 
 #=========================================
@@ -215,11 +219,16 @@ set_property(SOURCE ${UNRES_WHAM_M_PP_SRC} PROPERTY COMPILE_DEFINITIONS ${CPPFLA
 #========================================
 #  Setting binary name
 #========================================
+set(DFA "")
+set(HCD-5D "")
 if(UNRES_DFA)
- set(UNRES_WHAM_M_BIN "wham-mult_${Fortran_COMPILER_NAME}_MPI_${UNRES_MD_FF}_HCD-5D_DFA.exe")
-else(UNRES_DFA)
- set(UNRES_WHAM_M_BIN "wham-mult_${Fortran_COMPILER_NAME}_MPI_${UNRES_MD_FF}_HCD-5D.exe")
-endif(UNRES_DFA)
+ set(DFA "_DFA")
+endif()
+if(UNRES_5D)
+ set(HCD-5D "_HCD-5D")
+endif()
+
+set(UNRES_WHAM_M_BIN "wham-mult_${Fortran_COMPILER_NAME}_MPI_${UNRES_MD_FF}${HCD-5D}${DFA}.exe")
 #=========================================
 # cinfo.f workaround for CMake
 #=========================================