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INSTALL_DIR = /users/software/mpich2-1.4.1p1_gnu

FC= gfortran

OPT =  -O

FFLAGS = -c ${OPT} -I$(INSTALL_DIR)/include 
FFLAGS1 = -c -I$(INSTALL_DIR)/include 
FFLAGS2 = -c -O0 -I$(INSTALL_DIR)/include  
FFLAGS3 = -c -O -I$(INSTALL_DIR)/include  
FFLAGSE = -c -O3 -I$(INSTALL_DIR)/include

LIBS = -L$(INSTALL_DIR)/lib -lmpich -lmpl

ARCH = LINUX
PP = /lib/cpp -P


all: no_option
	@echo "Specify force field: GAB, E0LL2Y, 4P or CASP3"

.SUFFIXES: .F
.F.o:
	${FC} ${FFLAGS} ${CPPFLAGS} $*.F


object = unres_csa.o arcos.o cartprint.o chainbuild.o initialize_p.o \
        matmult.o readrtns_csa.o parmread.o \
        pinorm.o randgens.o rescode.o intcor.o timing.o misc.o intlocal.o \
        cartder.o checkder_p.o econstr_local.o energy_p_new_barrier.o \
	gradient_p.o minimize_p.o sumsld.o \
        cored.o rmdd.o geomout_min.o readpdb.o \
        intcartderiv.o \
        MP.o printmat.o convert.o int_to_cart.o \
	dfa.o \
        together.o csa.o minim_jlee.o shift.o diff12.o bank.o newconf.o ran.o \
        indexx.o prng_32.o contact.o gen_rand_conf.o \
        sc_move.o test.o local_move.o rmsd.o fitsq.o elecont.o djacob.o \
        distfit.o banach.o TMscore_subroutine.o minim_mult.o refsys.o gnmr1.o

no_option:

GAB: CPPFLAGS = -DPROCOR -DLINUX -DG77 -DAMD64 -DUNRES -DISNAN -DMP -DMPI \
	-DSPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC
GAB: BIN = ../../../bin/unres/CSA/unres_csa_gfort_MPICH_GAB.exe
GAB: ${object}
	cc -o compinfo compinfo.c
	./compinfo | true
	${FC} ${FFLAGS} cinfo.f
	${FC} ${OPT} ${object} cinfo.o ${LIBS}  -o ${BIN}

E0LL2Y: CPPFLAGS = -DPROCOR -DLINUX -DG77 -DAMD64 -DUNRES -DISNAN -DMP -DMPI \
	-DSPLITELE -DLANG0
E0LL2Y: BIN = ../../../bin/unres/CSA/unres_csa_gfort_MPICH_E0LL2Y.exe
E0LL2Y: ${object} 
	cc -o compinfo compinfo.c
	./compinfo | true
	${FC} ${FFLAGS} cinfo.f
	${FC} ${OPT} ${object} cinfo.o ${LIBS}  -o ${BIN}

CASP3: CPPFLAGS = -DLINUX -DG77 -DISNAN -DMP -DMPI -DUNRES \
           -DSPLITELE -DAMD64 -DLANG0 -DMOMENT \
           -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DCRYST_TOR
CASP3: BIN = ../../../bin/unres/CSA/unres_csa_gfort_MPICH_CASP3.exe
CASP3: ${object} 
	cc -o compinfo compinfo.c
	./compinfo | true
	${FC} ${FFLAGS} cinfo.f
	${FC} ${OPT} ${object} cinfo.o ${LIBS}  -o ${BIN}

4P: CPPFLAGS = -DLINUX -DG77 -DISNAN -DMP -DMPI -DUNRES \
           -DSPLITELE -DAMD64 -DLANG0 \
           -DCRYST_BOND -DCRYST_THETA -DCRYST_SC 
4P: BIN = ../../../bin/unres/CSA/unres_csa_gfort_MPICH_4P.exe
4P: ${object} 
	cc -o compinfo compinfo.c
	./compinfo | true
	${FC} ${FFLAGS} cinfo.f
	${FC} ${OPT} ${object} cinfo.o ${LIBS}  -o ${BIN}

clean:
	/bin/rm -f *.o && /bin/rm -f compinfo 

test.o: test.F
	${FC} ${FFLAGS} ${CPPFLAGS} test.F

chainbuild.o: chainbuild.F
	${FC} ${FFLAGS} ${CPPFLAGS} chainbuild.F

matmult.o: matmult.f
	${FC} ${FFLAGS} ${CPPFLAGS} matmult.f

parmread.o : parmread.F
	${FC} ${FFLAGS} ${CPPFLAGS} parmread.F

intcor.o : intcor.f
	${FC} ${FFLAGS} ${CPPFLAGS} intcor.f

cartder.o : cartder.F
	${FC} ${FFLAGS} ${CPPFLAGS} cartder.F

readpdb.o : readpdb.F
	${FC} ${FFLAGS2} ${CPPFLAGS} readpdb.F

sumsld.o : sumsld.f
	${FC} ${FFLAGS} ${CPPFLAGS} sumsld.f
        
cored.o : cored.f
	${FC} ${FFLAGS1} ${CPPFLAGS} cored.f
 
rmdd.o : rmdd.f
	${FC} ${FFLAGS} ${CPPFLAGS} rmdd.f

energy_p_new_barrier.o : energy_p_new_barrier.F
	${FC} ${FFLAGSE} ${CPPFLAGS} energy_p_new_barrier.F

gradient_p.o : gradient_p.F
	${FC} ${FFLAGSE} ${CPPFLAGS} gradient_p.F

energy_p_new-sep_barrier.o : energy_p_new-sep_barrier.F
	${FC} ${FFLAGSE} ${CPPFLAGS} energy_p_new-sep_barrier.F

lagrangian_lesyng.o : lagrangian_lesyng.F
	${FC} ${FFLAGSE} ${CPPFLAGS} lagrangian_lesyng.F

MD_A-MTS.o : MD_A-MTS.F
	${FC} ${FFLAGSE} ${CPPFLAGS} MD_A-MTS.F

blas.o : blas.f
	${FC} ${FFLAGS1} blas.f

add.o : add.f
	${FC} ${FFLAGS1} add.f

eigen.o : eigen.f
	${FC} ${FFLAGS2} eigen.f

proc_proc.o: proc_proc.c
	${CC} ${CFLAGS} proc_proc.c