1 CPPFLAGS = -WF,-DAIX -WF,-DISNAN -WF,-DUNRES -WF,-DMP -WF,-DMPI \
2 -WF,-DSPLITELE -WF,-DPROCOR -WF,-DAMD64 -WF,-DLANG0
3 #-WF,-DTIMING_ENE -WF,-DTIMING
4 # -WF,-DCRYST_BOND -WF,-DCRYST_THETA -WF,-DCRYST_SC
11 OPT = -O3 -qarch=450d -qtune=450
14 FFLAGS1 = -c -g -O3 -qarch=450d -qtune=450
15 FFLAGS2 = -c -g -O0 -qarch=450d -qtune=450
16 FFLAGSE = -c -O4 -qipa -Q+scalar -qhot=simd -qarch=450d -qtune=450
18 BIN = ../bin/unres_Tc_procor_new800_jugene.exe
19 LIBS = xdrf/libxdrf.a -qipa
29 ${FC} ${FFLAGS} ${CPPFLAGS} $*.F
32 object = unres.o arcos.o cartprint.o chainbuild.o convert.o initialize_p.o \
33 matmult.o readrtns_CSA.o parmread.o gen_rand_conf.o printmat.o map.o \
34 pinorm.o randgens.o rescode.o intcor.o timing.o misc.o intlocal.o \
35 cartder.o checkder_p.o econstr_local.o energy_p_new_barrier.o \
36 energy_p_new-sep_barrier.o gradient_p.o minimize_p.o sumsld.o \
37 cored.o rmdd.o geomout.o readpdb.o regularize.o thread.o fitsq.o mcm.o \
38 mc.o bond_move.o refsys.o check_sc_distr.o check_bond.o contact.o djacob.o \
39 eigen.o blas.o add.o entmcm.o minim_mcmf.o \
40 together.o csa.o minim_jlee.o shift.o diff12.o bank.o newconf.o ran.o \
41 indexx.o MP.o compare_s1.o prng.o \
42 test.o banach.o distfit.o rmsd.o elecont.o dihed_cons.o \
43 sc_move.o local_move.o \
44 intcartderiv.o lagrangian_lesyng.o\
45 stochfric.o kinetic_lesyng.o MD_A-MTS.o moments.o int_to_cart.o \
46 surfatom.o sort.o muca_md.o MREMD.o rattle.o gauss.o energy_split-sep.o \
50 cc -o compinfo compinfo.c
52 ${FC} ${FFLAGS} cinfo.f
53 ${FC} ${OPT} ${object} cinfo.o ${LIBS} -o ${BIN}
60 ${FC} ${FFLAGS} ${CPPFLAGS} newconf.f
63 ${FC} ${FFLAGS} ${CPPFLAGS} bank.F
66 ${FC} ${FFLAGS} ${CPPFLAGS} diff12.f
69 ${FC} ${FFLAGS} ${CPPFLAGS} csa.f
72 ${FC} ${FFLAGS} ${CPPFLAGS} shift.F
75 ${FC} ${FFLAGS} ${CPPFLAGS} ran.f
77 together.o: together.F
78 ${FC} ${FFLAGS} ${CPPFLAGS} together.F
81 ${FC} ${FFLAGS} ${CPPFLAGS} test.F
83 chainbuild.o: chainbuild.F
84 ${FC} ${FFLAGS} ${CPPFLAGS} chainbuild.F
87 ${FC} ${FFLAGS} ${CPPFLAGS} matmult.f
89 parmread.o : parmread.F
90 ${FC} ${FFLAGS} ${CPPFLAGS} parmread.F
93 ${FC} ${FFLAGS} ${CPPFLAGS} intcor.f
96 ${FC} ${FFLAGS} ${CPPFLAGS} cartder.F
99 ${FC} ${FFLAGS2} ${CPPFLAGS} readpdb.F
102 ${FC} ${FFLAGS} ${CPPFLAGS} sumsld.f
105 ${FC} ${FFLAGS1} ${CPPFLAGS} cored.f
108 ${FC} ${FFLAGS} ${CPPFLAGS} rmdd.f
110 energy_p_new.o : energy_p_new.F
111 ${FC} ${FFLAGSE} ${CPPFLAGS} energy_p_new.F
113 lagrangian_lesyng.o : lagrangian_lesyng.F
114 ${FC} ${FFLAGSE} ${CPPFLAGS} lagrangian_lesyng.F
117 ${FC} ${FFLAGS2} fitsq.f