X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc-M%2FMakefile;h=24b3056b7fe6513ea7bb239bb10acc91fe3ac205;hb=ad2687da4ea0c0ddde6c400a60c4817a689b3dff;hp=8453cddeb7b08caf0a886e4bb11a3abc3a14980c;hpb=0874c4ea42598369272a66bf4a345dcf7bff8b1f;p=unres.git

diff --git a/source/wham/src-M/Makefile b/source/wham/src-M/Makefile
deleted file mode 120000
index 8453cdd..0000000
--- a/source/wham/src-M/Makefile
+++ /dev/null
@@ -1 +0,0 @@
-Makefile_MPICH_ifort
\ No newline at end of file
diff --git a/source/wham/src-M/Makefile b/source/wham/src-M/Makefile
new file mode 100644
index 0000000..24b3056
--- /dev/null
+++ b/source/wham/src-M/Makefile
@@ -0,0 +1,76 @@
+INSTALL_DIR = /users/software/mpich-1.2.7p1_intel-10.1_em64_ssh
+BIN = ../../../bin
+CC = cc
+FC = ifort
+#OPT = -O3 -ip -w
+OPT = -g -CB
+FFLAGS = -c ${OPT} -I. -I./include_unres -I$(INSTALL_DIR)/include
+#FFLAGS = -c -g -C -I. -I./include_unres -I$(INSTALL_DIR)/include
+LIBS = -L$(INSTALL_DIR)/lib -lmpich ../../lib/xdrf/libxdrf.a 
+#LIBS = -L$(INSTALL_DIR)/lib_pgi -lmpich -lpmpich -Vaxlib
+#CPPFLAGS = -DMPI -DLINUX -DUNRES -DMOMENT -DCHECKGRAD -DPGI
+#CPPFLAGS = -DMPI -DLINUX -DUNRES -DCHECKGRAD -DPGI -DMYGETENV
+CPPFLAGS = -DMPI -DLINUX -DUNRES -DSPLITELE -DPROCOR -DPGI -DCRYST_BOND -DCRYST_SC -DCRYST_THETA 
+#CPPFLAGS = -DMPI -DLINUX -DUNRES -DPGI
+#CPPFLAGS = -DMPI -DLINUX -DUNRES
+
+.f.o:
+	${FC} ${FFLAGS} $*.f
+
+.F.o:
+	${FC} ${FFLAGS} ${CPPFLAGS} $*.F
+
+all: make_dbase
+
+objects = \
+	wham_multparm.o \
+	bxread.o \
+	xread.o \
+	cxread.o \
+	enecalc1.o \
+	energy_p_new.o \
+	gnmr1.o \
+	initialize_p.o \
+	molread_zs.o \
+	openunits.o \
+	readrtns.o \
+	read_dist_constr.o \
+	arcos.o \
+	cartder.o \
+	cartprint.o \
+	chainbuild.o \
+	geomout.o \
+	icant.o \
+	intcor.o \
+	int_from_cart.o \
+	make_ensemble1.o \
+	matmult.o \
+	misc.o \
+	mygetenv.o \
+	parmread.o \
+	pinorm.o \
+	printmat.o \
+	proc_proc.o \
+	rescode.o \
+	setup_var.o \
+	slices.o \
+	store_parm.o \
+	timing.o \
+	wham_calc1.o
+
+objects_compar = \
+        readrtns_compar.o \
+        readpdb.o permut.o fitsq.o contact.o \
+        elecont.o contfunc.o cont_frag.o conf_compar.o match_contact.o \
+        angnorm.o odlodc.o promienie.o qwolynes.o read_ref_str.o \
+        rmscalc.o secondary.o proc_cont.o define_pairs.o mysort.o
+
+make_dbase: ${objects} ${objects_compar}
+	cc -o compinfo compinfo.c
+	./compinfo
+	${FC} -c ${FFLAGS} cinfo.f
+	$(FC) ${OPT} ${objects} ${objects_compar} cinfo.o \
+	${LIBS} -o ${BIN}/wham_multparm-D-sccor-oldparm
+
+clean:
+	/bin/rm *.o