FC = ifort FFLAGS = -c ${OPT} -I$(INSTALL_DIR)/include FFLAGS1 = -c -w -g -d2 -CA -CB -I$(INSTALL_DIR)/include FFLAGS2 = -c -w -g -O0 -I$(INSTALL_DIR)/include FFLAGSE = -c -w -O3 -ipo -ipo_obj -opt_report -I$(INSTALL_DIR)/include CC = cc CFLAGS = -DLINUX -DPGI -c OPT = -O3 -ip -w # -Mvect <---slows down # -Minline=name:matmat2 <---false convergence LIBS = -Lxdrf -lxdrf #-DMOMENT #-DCO_BIAS #-DCRYST_TOR #-DDEBUG ARCH = LINUX PP = /lib/cpp -P all: @echo "Specify force field: GAB or E0LL2Y" .SUFFIXES: .F .F.o: ${FC} ${FFLAGS} ${CPPFLAGS} $*.F object = unres.o arcos.o cartprint.o chainbuild.o convert.o initialize_p.o \ matmult.o readrtns.o parmread.o gen_rand_conf.o printmat.o map.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.o readpdb.o regularize.o fitsq.o \ bond_move.o refsys.o check_bond.o contact.o \ MP.o prng.o \ rmsd.o elecont.o dihed_cons.o \ sc_move.o local_move.o \ intcartderiv.o \ int_to_cart.o \ gnmr1.o djacob.o openunits.o GAB: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DUNRES -DISNAN \ -DSPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC GAB: BIN = ../../../bin/unres/MD/unres_ifort_single_decoy_GAB.exe GAB: ${object} xdrf/libxdrf.a cc -o compinfo compinfo.c ./compinfo | true ${FC} ${FFLAGS} cinfo.f ${FC} ${OPT} ${object} cinfo.o ${LIBS} -o ${BIN} E0LL2Y: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DUNRES -DISNAN \ -DSPLITELE -DLANG0 E0LL2Y: BIN = ../../../bin/unres/MD/unres_ifort_single_decoy_E0LL2Y.exe E0LL2Y: ${object} xdrf/libxdrf.a cc -o compinfo compinfo.c ./compinfo | true ${FC} ${FFLAGS} cinfo.f ${FC} ${OPT} ${object} cinfo.o ${LIBS} -o ${BIN} xdrf/libxdrf.a: cd xdrf && make clean: /bin/rm -f *.o && /bin/rm -f compinfo && cd xdrf && make clean 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 proc_proc.o: proc_proc.c ${CC} ${CFLAGS} proc_proc.c