source/wham/src-M-SAXS/Makefile_MPICH_ifort-okeanos

   1 BIN = ~/bin
   2 FC = ftn
   3 #OPT = -intel-static -mcmodel=medium -O3 -ip -w
   4 OPT = -O3 -ip -mcmodel=medium -shared-intel -dynamic
   5 #OPT = -O3 -ip -w
   6 #OPT = -g -CB -mcmodel=medium -shared-intel -dynamic
   7 FFLAGS = ${OPT} -c -I. -I./include_unres -I$(INSTALL_DIR)/include
   8 LIBS = -L$(INSTALL_DIR)/lib -lmpich xdrf/libxdrf.a
   9
  10 .f.o:
  11         ${FC} ${FFLAGS} $*.f
  12
  13 .F.o:
  14         ${FC} ${FFLAGS} ${CPPFLAGS} $*.F
  15
  16 objects = \
  17         wham_multparm.o \
  18         bxread.o \
  19         xread.o \
  20         cxread.o \
  21         enecalc1.o \
  22         energy_p_new.o \
  23         gnmr1.o \
  24         initialize_p.o \
  25         molread_zs.o \
  26         openunits.o \
  27         readrtns.o \
  28         arcos.o \
  29         cartder.o \
  30         cartprint.o \
  31         chainbuild.o \
  32         geomout.o \
  33         icant.o \
  34         intcor.o \
  35         int_from_cart.o \
  36         make_ensemble1.o \
  37         matmult.o \
  38         misc.o \
  39         mygetenv.o \
  40         parmread.o \
  41         permut.o \
  42         seq2chains.o \
  43         chain_symmetry.o \
  44         iperm.o \
  45         pinorm.o \
  46         printmat.o \
  47         proc_proc.o \
  48         rescode.o \
  49         setup_var.o \
  50         slices.o \
  51         store_parm.o \
  52         timing.o \
  53         wham_calc1.o \
  54         PMFprocess.o \
  55         ssMD.o \
  56         oligomer.o
  57
  58 objects_compar = \
  59         readrtns_compar.o \
  60         readpdb.o fitsq.o contact.o \
  61         elecont.o contfunc.o cont_frag.o conf_compar.o match_contact.o \
  62         angnorm.o odlodc.o promienie.o qwolynes.o read_ref_str.o \
  63         rmscalc.o secondary.o proc_cont.o define_pairs.o mysort.o
  64
  65 all: no_option
  66         @echo "Specify force field: GAB, 4P or E0LL2Y"
  67
  68 no_option:
  69
  70 GAB: CPPFLAGS = -DMPI -DLINUX -DUNRES -DSPLITELE -DPROCOR -DPGI -DISNAN -DAMD64 \
  71         -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DWHAM
  72 GAB: ${objects} ${objects_compar} xdrf/libxdrf.a
  73         gcc -o compinfo compinfo.c
  74         ./compinfo
  75         ${FC} -c ${FFLAGS} cinfo.f
  76         $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o \
  77         ${LIBS} -o ${BIN}/wham_ifort_KCC_MPICH-okeanos_GAB-SAXS-NMRAMB-Bfac.exe
  78
  79 4P: CPPFLAGS = -DMPI -DLINUX -DUNRES -DSPLITELE -DPGI -DISNAN -DAMD64 \
  80         -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DWHAM
  81 4P: ${objects} ${objects_compar} xdrf/libxdrf.a
  82         gcc -o compinfo compinfo.c
  83         ./compinfo
  84         ${FC} -c ${FFLAGS} cinfo.f
  85         $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o \
  86         ${LIBS} -o ${BIN}/wham_ifort_KCC_MPICH-okeanos_4P-SAXS-NMRAMB-Bfac.exe
  87
  88 E0LL2Y: CPPFLAGS = -DMPI -DLINUX -DUNRES -DSPLITELE -DPROCOR -DPGI -DISNAN -DAMD64 -DWHAM
  89 E0LL2Y: ${objects} ${objects_compar} xdrf/libxdrf.a
  90         gcc -o compinfo compinfo.c
  91         ./compinfo
  92         ${FC} -c ${FFLAGS} cinfo.f
  93         $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o \
  94         ${LIBS} -o ${BIN}/wham_ifort_KCC_MPICH-okeanos_E0LL2Y-SAXS-NMRAMB-Bfac.exe
  95
  96 NEWCORR: CPPFLAGS = -DMPI -DLINUX -DUNRES -DSPLITELE -DPROCOR -DNEWCORR -DCORRCD -DPGI -DISNAN -DAMD64 -DWHAM
  97 NEWCORR: ${objects} ${objects_compar} xdrf/libxdrf.a
  98         gcc -o compinfo compinfo.c
  99         ./compinfo
 100         ${FC} -c ${FFLAGS} cinfo.f
 101         $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o \
 102         ${LIBS} -o ${BIN}/wham_ifort_KCC_MPICH-okeanos_NEWCORR-adapt-fouriertor-corrCD-SAXS-NMRAMB-Bfac.exe
 103
 104 xdrf/libxdrf.a:
 105         cd xdrf && make
 106
 107
 108 clean:
 109         /bin/rm -f *.o && /bin/rm -f compinfo && cd xdrf && make clean
 110