source/wham/src-new/Makefile

   1 ###################################################################
   2 INSTALL_DIR = /opt/cray/mpt/7.3.2/gni/mpich-intel/15.0
   3
   4
   5 CC = gcc
   6 FC = /opt/cray/craype/2.5.3/bin/ftn
   7
   8 OPT =  -O3 -ip
   9 #OPT =  -g -CA -CB
  10
  11 FFLAGS = ${OPT} -c -I. -I./include_unres -I$(INSTALL_DIR)/include
  12 LIBS = -L$(INSTALL_DIR)/lib -lmpich xdrf/libxdrf.a
  13
  14 .f.o:
  15         ${FC} ${FFLAGS} $*.f
  16
  17 .F.o:
  18         ${FC} ${FFLAGS} ${CPPFLAGS} $*.F
  19
  20 all: make_dbase
  21
  22 objects = \
  23         wham_multparm.o \
  24         bxread.o \
  25         xread.o \
  26         cxread.o \
  27         enecalc1.o \
  28         energy_p_new.o \
  29         initialize_p.o \
  30         molread_zs.o \
  31         openunits.o \
  32         gnmr1.o \
  33         readrtns.o \
  34         arcos.o \
  35         cartder.o \
  36         cartprint.o \
  37         chainbuild.o \
  38         geomout.o \
  39         icant.o \
  40         intcor.o \
  41         int_from_cart.o \
  42         make_ensemble1.o \
  43         matmult.o \
  44         misc.o \
  45         mygetenv.o \
  46         parmread.o \
  47         pinorm.o \
  48         printmat.o \
  49         proc_proc.o \
  50         rescode.o \
  51         setup_var.o \
  52         slices.o \
  53         store_parm.o \
  54         timing.o \
  55         wham_calc1.o \
  56         ssMD.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 GAB: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DAMD64 -DUNRES -DISNAN -DMPI -DWHAM \
  66         -DSPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC\
  67         -DSCCORPDB
  68 GAB: BIN = /lustre/tetyda/home/liwo/bin/wham_intel_MPI_GAB.exe
  69 GAB: ${objects} ${objects_compar} xdrf/libxdrf.a
  70         cc -o compinfo compinfo.c
  71         ./compinfo | true
  72         ${FC} ${FFLAGS} cinfo.f
  73         ${FC} ${OPT} ${objects} ${objects_compar} cinfo.o ${LIBS}  -o ${BIN}
  74
  75 E0LL2Y: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DAMD64 -DUNRES -DISNAN -DMPI -DWHAM \
  76         -DSPLITELE -DLANG0
  77 E0LL2Y: BIN = /lustre/tetyda/home/liwo/bin/unres/MD/wham_intel_MPI_E0LL2Y.exe
  78 E0LL2Y: ${objects} ${objects_compar} xdrf/libxdrf.a
  79         cc -o compinfo compinfo.c
  80         ./compinfo | true
  81         ${FC} ${FFLAGS} cinfo.f
  82         ${FC} ${OPT} ${objects} ${objects_compar} cinfo.o ${LIBS}  -o ${BIN}
  83
  84 xdrf/libxdrf.a:
  85         cd ../../lib/xdrf && make
  86
  87
  88 clean:
  89         /bin/rm -f *.o && /bin/rm -f compinfo && cd xdrf && make clean
  90
  91 clean:
  92         /bin/rm *.o