source/maxlik/src_MD_T_maxlik-NEWCORR-PMF-5/Makefile-MPICH-okeanos

   1 #INSTALL_DIR = /opt/cray/mpt/7.3.2/gni/mpich-intel/15.0
   2 BINDIR = ~/bin
   3 CC = gcc
   4 #FC = /opt/cray/craype/2.5.3/bin/ftn
   5 FC = ftn
   6 #FC = /opt/intel/bin/ifort
   7 #OPT = -mcmodel=medium -shared-intel -dynamic -g -CA -CB
   8 OPT = -O2 -mcmodel=medium -shared-intel -dynamic
   9 OPT1 = -O0 -mcmodel=medium -shared-intel -dynamic
  10 OPT2 = -O3 -mcmodel=medium -shared-intel -dynamic
  11 #OPT2 = ${OPT}
  12 #OPT1 =
  13 #OPT = -O2 -ip -w
  14 #OPT1 = -O2 -ip -w
  15 #OPT2 = -w -O3 -ipo -ipo_obj  -opt_report
  16 CFLAGS = -c
  17 FFLAGS = ${OPT} -c -I. -I./include_unres -I$(INSTALL_DIR)/include
  18 FFLAGS1 = ${OPT1} -c -I. -I./include_unres -I$(INSTALL_DIR)/include
  19 FFLAGS2 = ${OPT2} -c -I. -I./include_unres -I$(INSTALL_DIR)/include
  20 LIBS = -L$(INSTALL_DIR)/lib -lmpich xdrf/libxdrf.a
  21 .f.o:
  22         ${FC} ${FFLAGS} $*.f
  23
  24 .F.o:
  25         ${FC} ${FFLAGS} ${CPPFLAGS} $*.F
  26
  27 all: maxlik
  28
  29 objects = \
  30         zscorez.o \
  31         amebsa.o \
  32         amotsa.o \
  33         arcos.o \
  34         averages_sc.o \
  35         cartder.o \
  36         cartprint.o \
  37         chainbuild.o \
  38         convert.o \
  39         cored.o \
  40         cutoff_violation.o \
  41         energy_p_new_sc.o \
  42         func1_sc.o \
  43         geomout.o \
  44         gnmr1.o \
  45         icant.o \
  46         initialize_p.o \
  47         intcor.o \
  48         int_from_cart1.o \
  49         make_list_sc.o \
  50         matmult.o \
  51         minimize.o \
  52         misc.o \
  53         mygetenv.o \
  54         molread_zs.o \
  55         openunits.o \
  56         parmread.o \
  57         pinorm.o \
  58         printmat.o \
  59         proc.o \
  60         ran1.o \
  61         randgens.o \
  62         random.o \
  63         readrtns_MP.o \
  64         refsys.o \
  65         rescode.o \
  66         restart.o \
  67         rmdd.o \
  68         scan.o \
  69         setup_var.o \
  70         sumsl_a.o \
  71         sumsld.o \
  72         thermal.o \
  73         timing.o \
  74         maxlikopt.o \
  75         w2x_eps.o \
  76         pmfread.o \
  77         funder_eello.o \
  78         chain_symmetry.o \
  79         seq2chains.o \
  80         permut.o
  81
  82 objects_compar = \
  83         fitsq.o \
  84         lmysort.o \
  85         q_measure1.o \
  86         q_measure_self.o \
  87         readpdb.o \
  88         readrtns_compar.o \
  89         rmscalc.o
  90
  91 all: no_option
  92         @echo "Specify force field: GAB, E0LL2Y or NEWCORR"
  93
  94 no_option:
  95
  96 GAB: CPPFLAGS = -DMPI -DLINUX -DISNAN -DPROCOR -DSPLITELE -DPGI -DWEIDIST \
  97         -DCRYST_BOND -DCRYST_THETA -DCRYST_SC
  98 GAB: BIN = ${BINDIR}/zscorezMD_maxlik-ifort-GAB.exe
  99 GAB: ${objects} ${objects_compar} xdrf/libxdrf.a
 100         gcc -o compinfo compinfo.c
 101         ./compinfo | true
 102         ${FC} ${FFLAGS} cinfo.f
 103         ${FC} ${OPT} ${objects} ${objects_compar} cinfo.o ${LIBS} -o ${BIN}
 104
 105 E0LL2Y: CPPFLAGS = -DMPI -DLINUX -DISNAN -DPROCOR -DSPLITELE -DPGI -DWEIDIST #-DCHECKGRAD #-DOUT_PTAB -DOUT_LIK #-DZCHECK
 106 E0LL2Y: ${objects} ${objects_compar} xdrf/libxdrf.a
 107         gcc -o compinfo compinfo.c
 108         ./compinfo
 109         ${FC} -c ${FFLAGS} cinfo.f
 110         $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o ${LIBS} \
 111          -o ${BINDIR}/zscorezMD_maxlik-ifort-E0LL2Y.exe
 112
 113 NEWCORR: CPPFLAGS = -DMPI -DLINUX -DISNAN -DPROCOR -DSPLITELE -DPGI -DWEIDIST -DNEWCORR #-DCHECKGRAD #-DOUT_PTAB -DOUT_LIK #-DZCHECK
 114 NEWCORR: ${objects} ${objects_compar} xdrf/libxdrf.a
 115         gcc -o compinfo compinfo.c
 116         ./compinfo
 117         ${FC} -c ${FFLAGS} cinfo.f
 118         $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o ${LIBS} \
 119          -o ${BINDIR}/zscorezMD_maxlik-ifort-NEWCORR-splitfourier-PMF-5.exe
 120
 121 sumsld.o: sumsld.f
 122         ${FC} ${FFLAGS1} sumsld.f
 123
 124 sumsl_a.o: sumsl_a.f
 125         ${FC} ${FFLAGS1} sumsl_a.f
 126
 127 cored.o: cored.f
 128         ${FC} ${FFLAGS1} cored.f
 129
 130 rmdd.o: rmdd.f
 131         ${FC} ${FFLAGS1} rmdd.f
 132
 133 energy_p_new_sc.o: energy_p_new_sc.F
 134         ${FC} ${FFLAGS2} ${CPPFLAGS} energy_p_new_sc.F
 135
 136 funder_eello.o: funder_eello.F
 137         ${FC} ${FFLAGS2} ${CPPFLAGS} funder_eello.F
 138
 139 q_measure1.o: q_measure1.F
 140         ${FC} ${FFLAGS2} ${CPPFLAGS} q_measure1.F
 141
 142 q_measure_self.o: q_measure_self.F
 143         ${FC} ${FFLAGS2} ${CPPFLAGS} q_measure_self.F
 144
 145 averages.o: averages.F
 146         ${FC} ${FFLAGS2} ${CPPFLAGS} averages.F
 147
 148 fitsq.o: fitsq.f
 149         ${FC} ${FFLAGS2} fitsq.f
 150
 151 isnan.o: isnan.f
 152         ${FC} -Kieee -c isnan.f
 153
 154 clean:
 155         /bin/rm *.o