1 INSTALL_DIR = /opt/cray/mpt/7.3.2/gni/mpich-intel/15.0
4 FC = /opt/cray/craype/2.5.3/bin/ftn
5 #FC = /opt/intel/bin/ifort
6 OPT = -mcmodel=medium -shared-intel -dynamic -g -CA -CB
7 #OPT = -O2 -mcmodel=medium -shared-intel -dynamic
8 OPT1 = -O0 -mcmodel=medium -shared-intel -dynamic
9 #OPT2 = -O3 -mcmodel=medium -shared-intel -dynamic
14 #OPT2 = -w -O3 -ipo -ipo_obj -opt_report
16 FFLAGS = ${OPT} -c -I. -I./include_unres -I$(INSTALL_DIR)/include
17 FFLAGS1 = ${OPT1} -c -I. -I./include_unres -I$(INSTALL_DIR)/include
18 FFLAGS2 = ${OPT2} -c -I. -I./include_unres -I$(INSTALL_DIR)/include
19 LIBS = -L$(INSTALL_DIR)/lib -lmpich xdrf/libxdrf.a
24 ${FC} ${FFLAGS} ${CPPFLAGS} $*.F
86 @echo "Specify force field: GAB, E0LL2Y or NEWCORR"
90 GAB: CPPFLAGS = -DMPI -DLINUX -DISNAN -DPROCOR -DSPLITELE -DPGI -DWEIDIST \
91 -DNEWCORR -DCRYST_BOND -DCRYST_THETA -DCRYST_SC
92 GAB: BIN = ${BINDIR}/zscorezMD_maxlik-ifort-GAB.exe
93 GAB: ${objects} ${objects_compar} xdrf/libxdrf.a
94 gcc -o compinfo compinfo.c
96 ${FC} ${FFLAGS} cinfo.f
97 ${FC} ${OPT} ${objects} ${objects_compar} cinfo.o ${LIBS} -o ${BIN}
99 E0LL2Y: CPPFLAGS = -DMPI -DLINUX -DISNAN -DPROCOR -DSPLITELE -DPGI -DWEIDIST #-DCHECKGRAD #-DOUT_PTAB -DOUT_LIK #-DZCHECK
100 E0LL2Y: ${objects} ${objects_compar} xdrf/libxdrf.a
101 gcc -o compinfo compinfo.c
103 ${FC} -c ${FFLAGS} cinfo.f
104 $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o ${LIBS} \
105 -o ${BINDIR}/zscorezMD_maxlik-ifort-E0LL2Y.exe
107 NEWCORR: CPPFLAGS = -DMPI -DLINUX -DISNAN -DPROCOR -DSPLITELE -DPGI -DWEIDIST -DNEWCORR #-DCHECKGRAD #-DOUT_PTAB -DOUT_LIK #-DZCHECK
108 NEWCORR: ${objects} ${objects_compar} xdrf/libxdrf.a
109 gcc -o compinfo compinfo.c
111 ${FC} -c ${FFLAGS} cinfo.f
112 $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o ${LIBS} \
113 -o ${BINDIR}/zscorezMD_maxlik-ifort-NEWCORR-splitfourier.exe
116 ${FC} ${FFLAGS1} sumsld.f
119 ${FC} ${FFLAGS1} sumsl_a.f
122 ${FC} ${FFLAGS1} cored.f
125 ${FC} ${FFLAGS1} rmdd.f
127 energy_p_new_sc.o: energy_p_new_sc.F
128 ${FC} ${FFLAGS2} ${CPPFLAGS} energy_p_new_sc.F
130 q_measure1.o: q_measure1.F
131 ${FC} ${FFLAGS2} ${CPPFLAGS} q_measure1.F
133 q_measure_self.o: q_measure_self.F
134 ${FC} ${FFLAGS2} ${CPPFLAGS} q_measure_self.F
136 averages.o: averages.F
137 ${FC} ${FFLAGS2} ${CPPFLAGS} averages.F
140 ${FC} ${FFLAGS2} fitsq.f
143 ${FC} -Kieee -c isnan.f