X-Git-Url: http://mmka.chem.univ.gda.pl/gitweb/?a=blobdiff_plain;f=source%2Fwham%2Fsrc%2FMakefile_MPICH_ifort;h=7ef235d44f818c1aab1f913b401b98de94b11a68;hb=0874c4ea42598369272a66bf4a345dcf7bff8b1f;hp=9be99a7ad4132f93eefb293ef00313d4f39b69bf;hpb=8f2aef346c425b9a9d9a768931954134dabd64ae;p=unres.git diff --git a/source/wham/src/Makefile_MPICH_ifort b/source/wham/src/Makefile_MPICH_ifort index 9be99a7..7ef235d 100644 --- a/source/wham/src/Makefile_MPICH_ifort +++ b/source/wham/src/Makefile_MPICH_ifort @@ -55,6 +55,11 @@ objects_compar = \ angnorm.o odlodc.o promienie.o qwolynes.o read_ref_str.o \ rmscalc.o secondary.o proc_cont.o define_pairs.o mysort.o +all: no_option + @echo "Specify force field: GAB, 4P or E0LL2Y" + +no_option: + GAB: CPPFLAGS = -DMPI -DLINUX -DUNRES -DSPLITELE -DPROCOR -DPGI -DISNAN -DAMD64 \ -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DWHAM GAB: ${objects} ${objects_compar} xdrf/libxdrf.a @@ -62,7 +67,16 @@ GAB: ${objects} ${objects_compar} xdrf/libxdrf.a ./compinfo ${FC} -c ${FFLAGS} cinfo.f $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o \ - ${LIBS} -static-intel -o ${BIN}/wham_ifort_MPICH_GAB-DEBUG.exe + ${LIBS} -static-intel -o ${BIN}/wham_ifort_MPICH_GAB.exe + +4P: CPPFLAGS = -DMPI -DLINUX -DUNRES -DSPLITELE -DPGI -DISNAN -DAMD64 \ + -DCRYST_BOND -DCRYST_THETA -DCRYST_SC -DWHAM +4P: ${objects} ${objects_compar} xdrf/libxdrf.a + cc -o compinfo compinfo.c + ./compinfo + ${FC} -c ${FFLAGS} cinfo.f + $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o \ + ${LIBS} -static-intel -o ${BIN}/wham_ifort_MPICH_4P.exe E0LL2Y: CPPFLAGS = -DMPI -DLINUX -DUNRES -DSPLITELE -DPROCOR -DPGI -DISNAN -DAMD64 -DWHAM E0LL2Y: ${objects} ${objects_compar} xdrf/libxdrf.a @@ -70,7 +84,7 @@ E0LL2Y: ${objects} ${objects_compar} xdrf/libxdrf.a ./compinfo ${FC} -c ${FFLAGS} cinfo.f $(FC) ${OPT} ${objects} ${objects_compar} cinfo.o \ - ${LIBS} -static-intel -o ${BIN}/wham_ifort_MPICH_E0LL2Y-DEBUG.exe + ${LIBS} -static-intel -o ${BIN}/wham_ifort_MPICH_E0LL2Y.exe xdrf/libxdrf.a: cd xdrf && make