OOPSE/ac-tools/configure.in

dnl **** Process this file with autoconf to produce a configure script.

AC_INIT(OOPSE, 1.0, gezelter@nd.edu, oopse)
AC_CONFIG_AUX_DIR(ac-tools)

builtin(include, ac-tools/fortran90.m4)
builtin(include, ac-tools/aclocal.m4)


AC_CONFIG_SRCDIR([src/oopse.cpp])

AC_PREFIX_DEFAULT("/usr/local")

# set program name
PROGNAME="oopse"
AC_SUBST(PROGNAME)

# there are two ways to do debugging.  One with the --enable-debug flag
# and one using the DEBUG environment variable

debug=0
AC_ARG_ENABLE(debug, AC_HELP_STRING([--enable-debug], [Compile OOPSE in debug mode]), [debug=1])
if test "${DEBUG}"; then
        AC_DEFINE(debug, 1, [Code compiled in debug mode])
  msg="$msg, debug mode"
fi
AC_SUBST(debug)

# who am i
AC_CANONICAL_HOST

dnl Checks for programs.
AC_PROG_CC([icc xlc gcc cc])
AC_PROG_CXX([icpc icc xlC CC g++ c++])
AC_PROG_F90([ifc f90 xlf90 pgf90 epcf90 f95 xlf95 lf95 fort g95])
ACX_PROG_F90_PREPFLAG
ACX_PROG_F90_PREPDEFFLAG

case $debug in
  1) 
     ;;
  *) 
   ACX_PROG_CC_MAXOPT
   ACX_PROG_CXX_MAXOPT
   ACX_PROG_F90_MAXOPT
     ;;
esac

AC_PROG_INSTALL
AC_PROG_LN_S
AC_PROG_MAKE_SET
AC_PROG_RANLIB
AC_PROG_YACC
AC_PROG_LEX
AC_CHECK_PROG(AR, ar, ar, NONE)
if test "$AR" = "NONE"; then
  AC_MSG_ERROR(--> Can't find \`ar'!)
  AC_CACHE_SAVE
  exit 1
fi

AC_LANG_PUSH(Fortran 90)
AC_LANG_PREPROC(Fortran 90)
AC_F90_LIBRARY_LDFLAGS
dnl how Fortran mangles function names
AC_F90_WRAPPERS
AC_SUBST(F90_FUNC)
AC_SUBST(F90_FUNC_)

AC_MSG_CHECKING([for mpi-directory])
AC_ARG_WITH(mpi_dir,
              [  --with-mpi_dir=MPIDIR   give the path for MPI [/usr/local]],
                MPI_DIR="$withval", MPI_DIR="/usr/local")
AC_MSG_RESULT([$MPI_DIR])
AC_SUBST([mpi_dir])

AC_MSG_CHECKING([for mpi-lib-directory])
AC_ARG_WITH(mpi_libdir,
              [  --with-mpi-libdir=dir  give the path for MPI-libraries [MPI_DIR/lib]],
                MPI_LIBDIR="$withval", MPI_LIBDIR="$MPI_DIR/lib")
AC_MSG_RESULT([$MPI_LIBDIR])
AC_SUBST([MPI_LIBDIR])

AC_MSG_CHECKING([for mpi-inc-directory])
AC_ARG_WITH(mpi_inc,
              [  --with-mpi_inc=dir  give the path for MPI-include-files [MPI_DIR/include]],
                MPI_INC="$withval", MPI_INC="$MPI_DIR/include")
AC_MSG_RESULT([$MPI_INC])
AC_SUBST([MPI_INC])


AC_MSG_CHECKING([for MPI library])
MPI_LIB=""
case "$host" in
  *-ibm-aix*)                dnl IBM/SP2 machines
    dnl checking whether to use signal-based MPI

    AC_MSG_CHECKING([whether to use signal-based MPI library])
    AC_MSG_RESULT([$PACX_SIGNAL])
    if test "x$PACX_SIGNAL" = "xyes" ; then
      if test -f "$MPI_LIBDIR/libmpi.a" ; then
        MPI_LIB="-lmpi"
      elif test -f "$MPI_LIBDIR/libmpi.so" ; then
        MPI_LIB="-lmpi"
      elif test -f "$MPI_LIBDIR/libmpich.a" ; then
        MPI_LIB="-lmpich"
      else
        AC_MSG_ERROR([neither libmpi nor libmpich found; check path for MPI package first...])
      fi
    else
      if test -f "$MPI_LIBDIR/libmpi_r.a" ; then
         MPI_LIB="-lmpi_r"
      else
         AC_MSG_ERROR([libmpi_r not found; check path for MPI package...])
      fi
    fi
    AC_MSG_RESULT(found $MPI_LIB)
  ;;
  *)                         dnl All other machines
    if test -f "$MPI_LIBDIR/libmpi.a" ; then
      MPI_LIB="-lmpi"
    elif test -f "$MPI_LIBDIR/libmpi.so" ; then
      MPI_LIB="-lmpi"
    elif test -f "$MPI_LIBDIR/libmpich.a" ; then
      MPI_LIB="-lmpich"
    else
      AC_MSG_ERROR([neither libmpi nor libmpich found; check path for MPI package first...])
    fi
    AC_MSG_RESULT(found $MPI_LIB)
  ;;
esac
AC_SUBST(MPI_LIB)

ACX_MPI

AM_PATH_SPRNG
CHECK_MKL
AC_CHECK_MPI_F90MOD

AC_EXEEXT
AC_OBJEXT
OBJEXT=".$OBJEXT"

OOPSE=oopse

dnl **** define home dir of oopse
if test "x${prefix}" = "xNONE"
then
  OOPSE_HOME=${ac_default_prefix}/oopse
else
  OOPSE_HOME=${prefix}/oopse
fi
AC_ARG_ENABLE(oopse-home,
[  --enable-oopse-home=DIR      define oopse home dir [PREFIX/oopse]],
[OOPSE_HOME="${enableval}"])

case "x$INSTALL" in
   x/*) ;;
   *) INSTALL=`pwd`/ac-tools/"shtool install -c" ;
esac

MKINSTALLDIRS=`pwd`/ac-tools/"shtool mkdir -p -f"

dnl **** Final list of subdirs
SUBDIRS="libBASS libmdtools src forceFields samples utils utils/sysbuilder staticProps"

dnl **** Define CFLAGS etc empty to prevent configure from setting them
CFLAGS=${CFLAGS-""}
CXXFLAGS=${CXXFLAGS-""}
CPPFLAGS=${CPPFLAGS-""}
FFLAGS=${FFLAGS-""}
F90FLAGS=${F90FLAGS-""}
LDFLAGS=${LDFLAGS-""}
DEBUG=${DEBUG-"-g"}

case $debug in
  1) 
     CFLAGS="$DEBUG $CFLAGS"
     CXXFLAGS="$DEBUG $CXXFLAGS"
     FFLAGS="$DEBUG $FFLAGS"
     F90FLAGS="$DEBUG $F90FLAGS"
     ;;
  *) 
     ;;
esac


AC_SUBST(EXEEXT)
AC_SUBST(OBJEXT)
AC_SUBST(BATEXT)
AC_SUBST(MKINSTALLDIRS)
AC_SUBST(OOPSE)
AC_SUBST(OOPSE_HOME)
AC_SUBST(SUBDIRS)
AC_SUBST(CFLAGS)
AC_SUBST(CXXFLAGS)
AC_SUBST(CPPFLAGS)
AC_SUBST(FFLAGS)
AC_SUBST(F90FLAGS)
AC_SUBST(LDFLAGS)
AC_SUBST(PREPFLAG)
AC_SUBST(PREPDEFFLAG)
AC_CONFIG_HEADER([libmdtools/config.h])
AC_CONFIG_FILES([Makefile
        libBASS/Makefile libmdtools/Makefile src/Makefile utils/Makefile
        utils/sysbuilder/Makefile  forceFields/Makefile samples/Makefile
        staticProps/Makefile
        samples/alkane/Makefile samples/argon/Makefile
        samples/beadLipid/Makefile samples/lipid/Makefile
        samples/metals/Makefile samples/water/Makefile
])

AC_OUTPUT
Revision:	822
Committed:	Mon Oct 27 16:20:59 2003 UTC (20 years, 8 months ago) by gezelter
File size:	5175 byte(s)
Log Message:	fixes for configure, sysBuild
#	User	Rev	Content
1	mmeineke	377	dnl **** Process this file with autoconf to produce a configure script.
2
3	gezelter	747	AC_INIT(OOPSE, 1.0, gezelter@nd.edu, oopse)
4	mmeineke	377	AC_CONFIG_AUX_DIR(ac-tools)
5
6	gezelter	747	builtin(include, ac-tools/fortran90.m4)
7	mmeineke	377	builtin(include, ac-tools/aclocal.m4)
8
9
10	gezelter	747	AC_CONFIG_SRCDIR([src/oopse.cpp])
11	mmeineke	377
12	gezelter	747	AC_PREFIX_DEFAULT("/usr/local")
13	mmeineke	377
14	gezelter	747	# set program name
15			PROGNAME="oopse"
16			AC_SUBST(PROGNAME)
17
18	gezelter	822	# there are two ways to do debugging. One with the --enable-debug flag
19			# and one using the DEBUG environment variable
20
21			debug=0
22			AC_ARG_ENABLE(debug, AC_HELP_STRING([--enable-debug], [Compile OOPSE in debug mode]), [debug=1])
23	gezelter	747	if test "${DEBUG}"; then
24	gezelter	822	AC_DEFINE(debug, 1, [Code compiled in debug mode])
25	gezelter	747	msg="$msg, debug mode"
26	mmeineke	377	fi
27	gezelter	822	AC_SUBST(debug)
28	mmeineke	377
29	gezelter	747	# who am i
30			AC_CANONICAL_HOST
31	mmeineke	377
32	gezelter	747	dnl Checks for programs.
33			AC_PROG_CC([icc xlc gcc cc])
34	gezelter	816	AC_PROG_CXX([icpc icc xlC CC g++ c++])
35	gezelter	747	AC_PROG_F90([ifc f90 xlf90 pgf90 epcf90 f95 xlf95 lf95 fort g95])
36			ACX_PROG_F90_PREPFLAG
37			ACX_PROG_F90_PREPDEFFLAG
38	gezelter	822
39			case $debug in
40			1)
41			;;
42			*)
43			ACX_PROG_CC_MAXOPT
44			ACX_PROG_CXX_MAXOPT
45			ACX_PROG_F90_MAXOPT
46			;;
47			esac
48
49	gezelter	747	AC_PROG_INSTALL
50			AC_PROG_LN_S
51			AC_PROG_MAKE_SET
52			AC_PROG_RANLIB
53			AC_PROG_YACC
54			AC_PROG_LEX
55			AC_CHECK_PROG(AR, ar, ar, NONE)
56			if test "$AR" = "NONE"; then
57			AC_MSG_ERROR(--> Can't find \`ar'!)
58			AC_CACHE_SAVE
59			exit 1
60			fi
61	mmeineke	377
62	gezelter	747	AC_LANG_PUSH(Fortran 90)
63			AC_LANG_PREPROC(Fortran 90)
64			AC_F90_LIBRARY_LDFLAGS
65			dnl how Fortran mangles function names
66			AC_F90_WRAPPERS
67			AC_SUBST(F90_FUNC)
68			AC_SUBST(F90_FUNC_)
69	mmeineke	377
70	gezelter	747	AC_MSG_CHECKING([for mpi-directory])
71	gezelter	786	AC_ARG_WITH(mpi_dir,
72			[ --with-mpi_dir=MPIDIR give the path for MPI [/usr/local]],
73	gezelter	747	MPI_DIR="$withval", MPI_DIR="/usr/local")
74			AC_MSG_RESULT([$MPI_DIR])
75	gezelter	786	AC_SUBST([mpi_dir])
76	mmeineke	377
77	gezelter	747	AC_MSG_CHECKING([for mpi-lib-directory])
78	gezelter	786	AC_ARG_WITH(mpi_libdir,
79			[ --with-mpi-libdir=dir give the path for MPI-libraries [MPI_DIR/lib]],
80	gezelter	747	MPI_LIBDIR="$withval", MPI_LIBDIR="$MPI_DIR/lib")
81			AC_MSG_RESULT([$MPI_LIBDIR])
82			AC_SUBST([MPI_LIBDIR])
83	mmeineke	377
84	gezelter	747	AC_MSG_CHECKING([for mpi-inc-directory])
85	gezelter	786	AC_ARG_WITH(mpi_inc,
86			[ --with-mpi_inc=dir give the path for MPI-include-files [MPI_DIR/include]],
87	gezelter	747	MPI_INC="$withval", MPI_INC="$MPI_DIR/include")
88			AC_MSG_RESULT([$MPI_INC])
89			AC_SUBST([MPI_INC])
90	mmeineke	377
91
92	gezelter	747	AC_MSG_CHECKING([for MPI library])
93			MPI_LIB=""
94			case "$host" in
95			-ibm-aix) dnl IBM/SP2 machines
96			dnl checking whether to use signal-based MPI
97	mmeineke	377
98	gezelter	747	AC_MSG_CHECKING([whether to use signal-based MPI library])
99			AC_MSG_RESULT([$PACX_SIGNAL])
100			if test "x$PACX_SIGNAL" = "xyes" ; then
101			if test -f "$MPI_LIBDIR/libmpi.a" ; then
102			MPI_LIB="-lmpi"
103			elif test -f "$MPI_LIBDIR/libmpi.so" ; then
104			MPI_LIB="-lmpi"
105			elif test -f "$MPI_LIBDIR/libmpich.a" ; then
106			MPI_LIB="-lmpich"
107			else
108			AC_MSG_ERROR([neither libmpi nor libmpich found; check path for MPI package first...])
109			fi
110			else
111			if test -f "$MPI_LIBDIR/libmpi_r.a" ; then
112			MPI_LIB="-lmpi_r"
113			else
114			AC_MSG_ERROR([libmpi_r not found; check path for MPI package...])
115			fi
116			fi
117			AC_MSG_RESULT(found $MPI_LIB)
118			;;
119			*) dnl All other machines
120			if test -f "$MPI_LIBDIR/libmpi.a" ; then
121			MPI_LIB="-lmpi"
122			elif test -f "$MPI_LIBDIR/libmpi.so" ; then
123			MPI_LIB="-lmpi"
124			elif test -f "$MPI_LIBDIR/libmpich.a" ; then
125			MPI_LIB="-lmpich"
126			else
127			AC_MSG_ERROR([neither libmpi nor libmpich found; check path for MPI package first...])
128			fi
129			AC_MSG_RESULT(found $MPI_LIB)
130			;;
131			esac
132			AC_SUBST(MPI_LIB)
133	mmeineke	377
134	gezelter	747	ACX_MPI
135	mmeineke	377
136	gezelter	747	AM_PATH_SPRNG
137			CHECK_MKL
138	mmeineke	792	AC_CHECK_MPI_F90MOD
139	mmeineke	377
140			AC_EXEEXT
141			AC_OBJEXT
142			OBJEXT=".$OBJEXT"
143
144	gezelter	747	OOPSE=oopse
145	mmeineke	377
146	gezelter	747	dnl **** define home dir of oopse
147			if test "x${prefix}" = "xNONE"
148			then
149			OOPSE_HOME=${ac_default_prefix}/oopse
150	mmeineke	377	else
151	gezelter	747	OOPSE_HOME=${prefix}/oopse
152	mmeineke	377	fi
153	gezelter	747	AC_ARG_ENABLE(oopse-home,
154			[ --enable-oopse-home=DIR define oopse home dir [PREFIX/oopse]],
155			[OOPSE_HOME="${enableval}"])
156	mmeineke	377
157			case "x$INSTALL" in
158			x/*) ;;
159			*) INSTALL=`pwd`/ac-tools/"shtool install -c" ;
160			esac
161
162			MKINSTALLDIRS=`pwd`/ac-tools/"shtool mkdir -p -f"
163
164			dnl **** Final list of subdirs
165	mmeineke	809	SUBDIRS="libBASS libmdtools src forceFields samples utils utils/sysbuilder staticProps"
166	mmeineke	377
167	gezelter	747	dnl **** Define CFLAGS etc empty to prevent configure from setting them
168	mmeineke	794	CFLAGS=${CFLAGS-""}
169			CXXFLAGS=${CXXFLAGS-""}
170			CPPFLAGS=${CPPFLAGS-""}
171			FFLAGS=${FFLAGS-""}
172			F90FLAGS=${F90FLAGS-""}
173			LDFLAGS=${LDFLAGS-""}
174			DEBUG=${DEBUG-"-g"}
175	gezelter	747
176			case $debug in
177	gezelter	822	1)
178	gezelter	747	CFLAGS="$DEBUG $CFLAGS"
179			CXXFLAGS="$DEBUG $CXXFLAGS"
180			FFLAGS="$DEBUG $FFLAGS"
181			F90FLAGS="$DEBUG $F90FLAGS"
182			;;
183			*)
184			;;
185			esac
186
187
188			AC_SUBST(EXEEXT)
189			AC_SUBST(OBJEXT)
190			AC_SUBST(BATEXT)
191			AC_SUBST(MKINSTALLDIRS)
192			AC_SUBST(OOPSE)
193			AC_SUBST(OOPSE_HOME)
194			AC_SUBST(SUBDIRS)
195			AC_SUBST(CFLAGS)
196			AC_SUBST(CXXFLAGS)
197			AC_SUBST(CPPFLAGS)
198			AC_SUBST(FFLAGS)
199			AC_SUBST(F90FLAGS)
200			AC_SUBST(LDFLAGS)
201			AC_SUBST(PREPFLAG)
202			AC_SUBST(PREPDEFFLAG)
203			AC_CONFIG_HEADER([libmdtools/config.h])
204			AC_CONFIG_FILES([Makefile
205			libBASS/Makefile libmdtools/Makefile src/Makefile utils/Makefile
206			utils/sysbuilder/Makefile forceFields/Makefile samples/Makefile
207	mmeineke	809	staticProps/Makefile
208	gezelter	747	samples/alkane/Makefile samples/argon/Makefile
209			samples/beadLipid/Makefile samples/lipid/Makefile
210			samples/metals/Makefile samples/water/Makefile
211			])
212
213			AC_OUTPUT