| 9 |
|
builtin(include, ac-tools/AC_CXX_HAVE_STL.m4) |
| 10 |
|
builtin(include, ac-tools/AC_CXX_NAMESPACES.m4) |
| 11 |
|
builtin(include, ac-tools/AC_CXX_STD.m4) |
| 12 |
+ |
builtin(include, ac-tools/ACX_MPI.m4) |
| 13 |
|
builtin(include, ac-tools/CGAL.m4) |
| 14 |
|
|
| 15 |
|
# who am i |
| 57 |
|
AC_SUBST(USE_SINGLE_PRECISION) |
| 58 |
|
fi |
| 59 |
|
|
| 60 |
+ |
if test x"$CC" != x; then |
| 61 |
+ |
AC_CHECK_PROGS(ac_cc_set,[$CC],[no]) |
| 62 |
+ |
AS_IF([test AS_VAR_GET([ac_cc_set]) != no],[ |
| 63 |
+ |
AC_PATH_PROG(ac_cc_path,[$ac_cc_set],[no])],[ |
| 64 |
+ |
AC_ERROR([Specified C compiler $CC doesn't seem to exist!])]) |
| 65 |
+ |
|
| 66 |
+ |
AS_IF([test AS_VAR_GET([ac_cc_path]) != no],[ |
| 67 |
+ |
AC_MSG_NOTICE([Will attempt to use $CC as C compiler])],[ |
| 68 |
+ |
AC_ERROR([Can't find path to user-specified C compiler $CC])]) |
| 69 |
+ |
fi |
| 70 |
+ |
|
| 71 |
+ |
if test x"$CXX" != x; then |
| 72 |
+ |
AC_CHECK_PROGS(ac_cxx_set,[$CXX],[no]) |
| 73 |
+ |
AS_IF([test AS_VAR_GET([ac_cxx_set]) != no],[ |
| 74 |
+ |
AC_PATH_PROG(ac_cxx_path,[$ac_cxx_set],[no])],[ |
| 75 |
+ |
AC_ERROR([Specified C++ compiler $CXX doesn't seem to exist!])]) |
| 76 |
+ |
|
| 77 |
+ |
AS_IF([test AS_VAR_GET([ac_cxx_path]) != no],[ |
| 78 |
+ |
AC_MSG_NOTICE([Will attempt to use $CXX as C++ compiler])],[ |
| 79 |
+ |
AC_ERROR([Can't find path to user-specified C++ compiler $CXX])]) |
| 80 |
+ |
fi |
| 81 |
+ |
|
| 82 |
+ |
if test x"$FC" != x; then |
| 83 |
+ |
AC_CHECK_PROGS(ac_fc_set,[$FC],[no]) |
| 84 |
+ |
AS_IF([test AS_VAR_GET([ac_fc_set]) != no],[ |
| 85 |
+ |
AC_PATH_PROG(ac_fc_path,[$ac_fc_set],[no])],[ |
| 86 |
+ |
AC_ERROR([Specified Fortran compiler $FC doesn't seem to exist!])]) |
| 87 |
+ |
|
| 88 |
+ |
AS_IF([test AS_VAR_GET([ac_fc_path]) != no],[ |
| 89 |
+ |
AC_MSG_NOTICE([Will attempt to use $FC as Fortran compiler])],[ |
| 90 |
+ |
AC_ERROR([Can't find path to user-specified Fortran compiler $FC])]) |
| 91 |
+ |
fi |
| 92 |
+ |
|
| 93 |
+ |
|
| 94 |
+ |
dnl do MPI checks |
| 95 |
+ |
ACX_MPI([USE_MPI="yes"], |
| 96 |
+ |
[USE_MPI="no" |
| 97 |
+ |
AC_MSG_WARN([No suitable MPI implementation found. oopse_MPI will not be build.])]) |
| 98 |
+ |
AC_SUBST(USE_MPI) |
| 99 |
+ |
|
| 100 |
|
# Checks for programs. |
| 101 |
< |
AC_PROG_CXX([mpicxx icpc pathCC pgCC c++ xlc++ xlC g++ CC]) |
| 102 |
< |
AC_PROG_CC([mpicc icc pathcc pgcc cc xlc gcc]) |
| 103 |
< |
AC_PROG_FC([mpif90 ifort ifc pathf95 pgf95 xlf95 lf95 epcf90 pathf90 xlf90 f95 f90 gfortran g95 fort], 95) |
| 101 |
> |
AC_PROG_CXX([$CXX $ac_cv_prog_acx_mpi_mpicxx icpc pathCC pgCC c++ xlc++ xlC g++ CC]) |
| 102 |
> |
AC_PROG_CC([$CC $ac_cv_prog_acx_mpi_mpicc icc pathcc pgcc cc xlc gcc]) |
| 103 |
> |
AC_PROG_FC([$FC $ac_cv_prog_acx_mpi_mpif90 ifort ifc pathf95 pgf95 xlf95 lf95 epcf90 pathf90 xlf90 f95 f90 gfortran g95 fort], 95) |
| 104 |
|
AC_PROG_CPP |
| 105 |
|
AC_PROG_EGREP |
| 106 |
|
AC_PROG_LN_S |
| 107 |
|
AC_PROG_MAKE_SET |
| 108 |
|
AC_PROG_RANLIB |
| 109 |
+ |
AC_PROG_YACC |
| 110 |
+ |
AC_PROG_LEX |
| 111 |
|
AX_SYS_PERLSHARPBANG |
| 112 |
|
AC_PROG_INSTALL |
| 113 |
|
case "x$INSTALL" in |
| 189 |
|
AC_CHECK_LIB(m, asin, , exit) |
| 190 |
|
ACX_CHECK_ZLIB |
| 191 |
|
ACX_CHECK_FFTW |
| 192 |
+ |
ACX_CHECK_QHULL |
| 193 |
+ |
ACX_CHECK_OPENBABEL |
| 194 |
|
|
| 150 |
– |
|
| 195 |
|
# Checks for header files. |
| 196 |
|
AC_HEADER_STDC |
| 197 |
|
AC_CHECK_HEADERS([conio.h dlfcn.h fstream.h iostream.h libintl.h limits.h machine/hal_sysinfo.h math.h stddef.h stdio.h stdlib.h string.h strings.h strstream.h sys/param.h sys/pstat.h sys/sysmp.h sys/sysctl.h sys/sysinfo.h sys/systemcfg.h sys/table.h sys/time.h time.h unistd.h zlib.h]) |
| 278 |
|
dnl OpenBabel needs this: |
| 279 |
|
AC_DEFINE([OBAPI], [], [Used to export symbols for DLL / shared library builds]) |
| 280 |
|
|
| 237 |
– |
|
| 238 |
– |
AC_ARG_WITH(mpi, |
| 239 |
– |
[AC_HELP_STRING([--with-mpi=<prefix>], |
| 240 |
– |
[compile with MPI installed in <prefix> [default=no]])], |
| 241 |
– |
with_mpi=$withval, |
| 242 |
– |
with_mpi="no") |
| 243 |
– |
|
| 244 |
– |
case "x$with_mpi" in |
| 245 |
– |
xyes | "x") USE_MPI=yes;; |
| 246 |
– |
xno) USE_MPI=no ;; |
| 247 |
– |
*) MPI="$with_mpi"; USE_MPI=yes ;; |
| 248 |
– |
esac |
| 249 |
– |
if test "$USE_MPI" = "yes" -a -z "$with_mpi"; then |
| 250 |
– |
MPI="/usr/local" |
| 251 |
– |
fi |
| 252 |
– |
if test "$USE_MPI" = "yes"; then |
| 253 |
– |
ACX_MPI |
| 254 |
– |
fi |
| 255 |
– |
AC_SUBST(USE_MPI) |
| 256 |
– |
|
| 281 |
|
dnl check for CGAL library |
| 282 |
|
ACX_CGAL |
| 283 |
< |
|
| 283 |
> |
USE_CGAL=no |
| 284 |
|
if test "$acx_cgal_found" == yes; then |
| 285 |
< |
USE_CGAL=yes |
| 286 |
< |
AC_DEFINE(HAVE_CGAL, 1, [Is defined if the CGAL library is available.]) |
| 287 |
< |
AC_SUBST(USE_CGAL) |
| 288 |
< |
AC_SUBST(CGAL_CXXFLAGS) |
| 289 |
< |
AC_SUBST(CGAL_LDFLAGS) |
| 290 |
< |
AC_SUBST(CGAL_CPPFLAGS) |
| 267 |
< |
AC_SUBST(CGAL_LIBS) |
| 285 |
> |
USE_CGAL=yes |
| 286 |
> |
AC_DEFINE(HAVE_CGAL, 1, [Is defined if the CGAL library is available.]) |
| 287 |
> |
AC_SUBST(CGAL_CXXFLAGS) |
| 288 |
> |
AC_SUBST(CGAL_LDFLAGS) |
| 289 |
> |
AC_SUBST(CGAL_CPPFLAGS) |
| 290 |
> |
AC_SUBST(CGAL_LIBS) |
| 291 |
|
fi |
| 292 |
+ |
AC_SUBST(USE_CGAL) |
| 293 |
|
|
| 294 |
|
|
| 295 |
|
BB_ENABLE_DOXYGEN |
| 308 |
|
AC_SUBST(LDFLAGS) |
| 309 |
|
AC_SUBST(PREPDEFFLAG) |
| 310 |
|
AC_SUBST(F90_MODULE_NAMES) |
| 311 |
< |
AC_CONFIG_FILES([make/Makefile src/utils/Makefile src/math/Makefile src/applications/staticProps/Makefile scripts/filepp], [chmod 0755 scripts/*]) |
| 311 |
> |
AC_CONFIG_FILES([make/Makefile src/utils/Makefile src/math/Makefile src/applications/atom2md/Makefile scripts/filepp], [chmod 0755 scripts/*]) |
| 312 |
|
|
| 313 |
|
AC_OUTPUT |
