increase to 20 max nset waga_homology(20)

[unres.git] / source / cluster / wham / src / Makefile-MPICH-ifort

#INSTALL_DIR = /users/software/mpich-1.2.7p1_intel-10.1_em64_ssh
INSTALL_DIR = /users/local/mpich2-1.4.1p1_intel
BIN=../../../../bin/cluster
FC = ifort
OPT = -O3 -ip -w -mcmodel=medium -shared-intel
#OPT = -CB -g 
FFLAGS =  ${OPT} -c -I. -Iinclude_unres -I$(INSTALL_DIR)/include
CPPFLAGS = -DLINUX -DPGI -DSPLITELE -DPROCOR -DMP -DMPI -DCLUST
#LIBS = -L$(INSTALL_DIR)/lib -lmpich xdrf/libxdrf.a -g -d2 -CA -CB
LIBS = -L$(INSTALL_DIR)/lib -lmpich xdrf/libxdrf.a -lmpl

.c.o:
        cc -c -DLINUX -DPGI $*.c

.f.o:
        ${FC} ${FFLAGS} $*.f

.F.o:
        ${FC} ${FFLAGS} ${CPPFLAGS} ${FFLAGS} $*.F

objects = main_clust.o arcos.o cartprint.o chainbuild.o convert.o initialize_p.o \
        matmult.o readrtns.o pinorm.o rescode.o intcor.o timing.o misc.o \
        geomout.o readpdb.o read_coords.o parmread.o probabl.o fitsq.o hc.o  \
        track.o wrtclust.o srtclust.o noyes.o contact.o printmat.o \
        int_from_cart1.o energy_p_new.o icant.o proc_proc.o work_partition.o \
        setup_var.o read_ref_str.o gnmr1.o ssMD.o dfa.o

GAB: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DUNRES -DISNAN -DMP -DMPI -DCLUST \
        -DSPLITELE -DLANG0 -DCRYST_BOND -DCRYST_THETA -DCRYST_SC
GAB: $(objects) xdrf/libxdrf.a
        cc -o compinfo compinfo.c
        ./compinfo
        ${FC} -c ${FFLAGS} cinfo.f
        $(FC) ${OPT} ${objects} cinfo.o ${LIBS} -o ${BIN}/unres_clustMD_MPICH-restr-DFA-GAB.exe

E0LL2Y: CPPFLAGS = -DPROCOR -DLINUX -DPGI -DUNRES -DISNAN -DMP -DMPI -DCLUST \
        -DSPLITELE -DLANG0
E0LL2Y: $(objects) xdrf/libxdrf.a
        cc -o compinfo compinfo.c
        ./compinfo
        ${FC} -c ${FFLAGS} cinfo.f
        $(FC) ${OPT} ${objects} cinfo.o ${LIBS} -o ${BIN}/unres_clustMD_MPICH-restr-DFA-E0LL2Y.exe

xdrf/libxdrf.a:
        cd xdrf && make


clean:
        /bin/rm -f *.o && /bin/rm -f compinfo && cd xdrf && make clean