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root/OpenMD/branches/development/configure
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Comparing:
trunk/configure (file contents), Revision 1373 by gezelter, Tue Oct 20 13:13:45 2009 UTC vs.
branches/development/configure (file contents), Revision 1465 by chuckv, Fri Jul 9 23:08:25 2010 UTC

# Line 1 | Line 1
1   #! /bin/sh
2   # Guess values for system-dependent variables and create Makefiles.
3 < # Generated by GNU Autoconf 2.64 for OOPSE 4.0.
3 > # Generated by GNU Autoconf 2.65 for OpenMD 1.0.
4   #
5   # Report bugs to <gezelter@nd.edu>.
6   #
7 + #
8   # Copyright (C) 1992, 1993, 1994, 1995, 1996, 1998, 1999, 2000, 2001,
9 < # 2002, 2003, 2004, 2005, 2006, 2007, 2008, 2009 Free Software
10 < # Foundation, Inc.
9 > # 2002, 2003, 2004, 2005, 2006, 2007, 2008, 2009 Free Software Foundation,
10 > # Inc.
11 > #
12   #
13   # This configure script is free software; the Free Software Foundation
14   # gives unlimited permission to copy, distribute and modify it.
# Line 527 | Line 529 | as_tr_sh="eval sed 'y%*+%pp%;s%[^_$as_cr_alnum]%_%g'"
529   as_tr_sh="eval sed 'y%*+%pp%;s%[^_$as_cr_alnum]%_%g'"
530  
531  
532 < exec 7<&0 </dev/null 6>&1
532 > test -n "$DJDIR" || exec 7<&0 </dev/null
533 > exec 6>&1
534  
535   # Name of the host.
536   # hostname on some systems (SVR3.2, Linux) returns a bogus exit status,
# Line 547 | Line 550 | MAKEFLAGS=
550   MAKEFLAGS=
551  
552   # Identity of this package.
553 < PACKAGE_NAME='OOPSE'
554 < PACKAGE_TARNAME='oopse'
555 < PACKAGE_VERSION='4.0'
556 < PACKAGE_STRING='OOPSE 4.0'
553 > PACKAGE_NAME='OpenMD'
554 > PACKAGE_TARNAME='openmd'
555 > PACKAGE_VERSION='1.0'
556 > PACKAGE_STRING='OpenMD 1.0'
557   PACKAGE_BUGREPORT='gezelter@nd.edu'
558   PACKAGE_URL=''
559  
560 < ac_unique_file="src/applications/oopse/oopse.cpp"
560 > ac_unique_file="src/applications/openmd/openmd.cpp"
561   ac_default_prefix="/usr/local"
562   # Factoring default headers for most tests.
563   ac_includes_default="\
# Line 594 | Line 597 | SUBDIRS
597  
598   ac_subst_vars='LTLIBOBJS
599   SUBDIRS
600 < OOPSE_HOME
601 < OOPSE
600 > OPENMD_HOME
601 > OPENMD
602   MKINSTALLDIRS
603   BATEXT
604   enable_latex_docs
# Line 604 | Line 607 | DOXYGEN
607   DOC
608   DOT
609   DOXYGEN
607 USE_CGAL
608 CGAL_LIBS
609 CGAL_LDFLAGS
610 CGAL_CPPFLAGS
611 CGAL_CXXFLAGS
612 CGAL_MAKEFILE
610   POW_LIB
611   LIBOBJS
612   USE_OPENBABEL
# Line 653 | Line 650 | MPIFC
650   CPP
651   USE_MPI
652   MPIFC
653 + MPICC
654 + MPILIBS
655 + MPICXX
656 + LIBDL
657   ac_ct_FC
658   FCFLAGS
659   FC
659 MPICC
660   ac_ct_CC
661   CFLAGS
662   CC
663 MPILIBS
664 MPICXX
663   OBJEXT
664   EXEEXT
665   ac_ct_CXX
# Line 669 | Line 667 | CXX
667   LDFLAGS
668   CXXFLAGS
669   CXX
672 ac_fc_path
673 ac_fc_set
674 ac_cxx_path
675 ac_cxx_set
676 ac_cc_path
677 ac_cc_set
670   USE_SINGLE_PRECISION
671   debug
672   PROGNAME
# Line 727 | Line 719 | enable_option_checking
719   ac_subst_files=''
720   ac_user_opts='
721   enable_option_checking
722 < enable_oopse_home
722 > enable_openmd_home
723   enable_debug
724   enable_single
725   enable_float
# Line 736 | Line 728 | with_openbabel
728   with_fftw
729   with_qhull
730   with_openbabel
739 with_cgalmakefile
731   enable_doxygen
732   enable_dot
733   enable_html_docs
# Line 751 | Line 742 | CCC
742   LIBS
743   CPPFLAGS
744   CCC
754 MPICXX
745   CC
746   CFLAGS
757 MPICC
747   FC
748   FCFLAGS
749 + MPICXX
750 + MPICC
751   MPIFC
752   CPP
753   CXXCPP'
# Line 1301 | Line 1292 | if test "$ac_init_help" = "long"; then
1292    # Omit some internal or obsolete options to make the list less imposing.
1293    # This message is too long to be a string in the A/UX 3.1 sh.
1294    cat <<_ACEOF
1295 < \`configure' configures OOPSE 4.0 to adapt to many kinds of systems.
1295 > \`configure' configures OpenMD 1.0 to adapt to many kinds of systems.
1296  
1297   Usage: $0 [OPTION]... [VAR=VALUE]...
1298  
# Line 1349 | Line 1340 | Fine tuning of the installation directories:
1340    --infodir=DIR           info documentation [DATAROOTDIR/info]
1341    --localedir=DIR         locale-dependent data [DATAROOTDIR/locale]
1342    --mandir=DIR            man documentation [DATAROOTDIR/man]
1343 <  --docdir=DIR            documentation root [DATAROOTDIR/doc/oopse]
1343 >  --docdir=DIR            documentation root [DATAROOTDIR/doc/openmd]
1344    --htmldir=DIR           html documentation [DOCDIR]
1345    --dvidir=DIR            dvi documentation [DOCDIR]
1346    --pdfdir=DIR            pdf documentation [DOCDIR]
# Line 1366 | Line 1357 | if test -n "$ac_init_help"; then
1357  
1358   if test -n "$ac_init_help"; then
1359    case $ac_init_help in
1360 <     short | recursive ) echo "Configuration of OOPSE 4.0:";;
1360 >     short | recursive ) echo "Configuration of OpenMD 1.0:";;
1361     esac
1362    cat <<\_ACEOF
1363  
# Line 1374 | Line 1365 | Optional Features:
1365    --disable-option-checking  ignore unrecognized --enable/--with options
1366    --disable-FEATURE       do not include FEATURE (same as --enable-FEATURE=no)
1367    --enable-FEATURE[=ARG]  include FEATURE [ARG=yes]
1368 <  --enable-oopse-home=DIR      define oopse home dir PREFIX/oopse
1369 <  --enable-debug          Compile OOPSE in debug mode
1370 <  --enable-single         compile OOPSE in single precision
1368 >  --enable-openmd-home=DIR      define OpenMD home dir PREFIX/openmd
1369 >  --enable-debug          Compile OpenMD in debug mode
1370 >  --enable-single         compile OpenMD in single precision
1371    --enable-float          synonym for --enable-single
1372    --enable-doxygen        enable documentation generation with doxygen (auto)
1373    --enable-dot            use 'dot' to generate graphs in doxygen (auto)
# Line 1397 | Line 1388 | Optional Packages:
1388    --with-openbabel=DIR    root directory path of openbabel-2.x installation
1389                            (defaults to /usr/local or /usr if not found in
1390                            /usr/local)
1400  --with-cgalmakefile=makefile
1401                          Use the following CGAL makefile
1391  
1392   Some influential environment variables:
1393    CXX         C++ compiler command
# Line 1406 | Line 1395 | Some influential environment variables:
1395    LDFLAGS     linker flags, e.g. -L<lib dir> if you have libraries in a
1396                nonstandard directory <lib dir>
1397    LIBS        libraries to pass to the linker, e.g. -l<library>
1398 <  CPPFLAGS    C/C++/Objective C preprocessor flags, e.g. -I<include dir> if
1398 >  CPPFLAGS    (Objective) C/C++ preprocessor flags, e.g. -I<include dir> if
1399                you have headers in a nonstandard directory <include dir>
1411  MPICXX      MPI C++ compiler command
1400    CC          C compiler command
1401    CFLAGS      C compiler flags
1414  MPICC       MPI C compiler command
1402    FC          Fortran compiler command
1403    FCFLAGS     Fortran compiler flags
1404 +  MPICXX      MPI C++ compiler command
1405 +  MPICC       MPI C compiler command
1406    MPIFC       MPI Fortran compiler command
1407    CPP         C preprocessor
1408    CXXCPP      C++ preprocessor
# Line 1484 | Line 1473 | if $ac_init_version; then
1473   test -n "$ac_init_help" && exit $ac_status
1474   if $ac_init_version; then
1475    cat <<\_ACEOF
1476 < OOPSE configure 4.0
1477 < generated by GNU Autoconf 2.64
1476 > OpenMD configure 1.0
1477 > generated by GNU Autoconf 2.65
1478  
1479   Copyright (C) 2009 Free Software Foundation, Inc.
1480   This configure script is free software; the Free Software Foundation
# Line 1532 | Line 1521 | fi
1521          ac_retval=1
1522   fi
1523    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1524 <  return $ac_retval
1524 >  as_fn_set_status $ac_retval
1525  
1526   } # ac_fn_cxx_try_compile
1527  
1528 + # ac_fn_c_try_compile LINENO
1529 + # --------------------------
1530 + # Try to compile conftest.$ac_ext, and return whether this succeeded.
1531 + ac_fn_c_try_compile ()
1532 + {
1533 +  as_lineno=${as_lineno-"$1"} as_lineno_stack=as_lineno_stack=$as_lineno_stack
1534 +  rm -f conftest.$ac_objext
1535 +  if { { ac_try="$ac_compile"
1536 + case "(($ac_try" in
1537 +  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
1538 +  *) ac_try_echo=$ac_try;;
1539 + esac
1540 + eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
1541 + $as_echo "$ac_try_echo"; } >&5
1542 +  (eval "$ac_compile") 2>conftest.err
1543 +  ac_status=$?
1544 +  if test -s conftest.err; then
1545 +    grep -v '^ *+' conftest.err >conftest.er1
1546 +    cat conftest.er1 >&5
1547 +    mv -f conftest.er1 conftest.err
1548 +  fi
1549 +  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
1550 +  test $ac_status = 0; } && {
1551 +         test -z "$ac_c_werror_flag" ||
1552 +         test ! -s conftest.err
1553 +       } && test -s conftest.$ac_objext; then :
1554 +  ac_retval=0
1555 + else
1556 +  $as_echo "$as_me: failed program was:" >&5
1557 + sed 's/^/| /' conftest.$ac_ext >&5
1558 +
1559 +        ac_retval=1
1560 + fi
1561 +  eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1562 +  as_fn_set_status $ac_retval
1563 +
1564 + } # ac_fn_c_try_compile
1565 +
1566 + # ac_fn_fc_try_compile LINENO
1567 + # ---------------------------
1568 + # Try to compile conftest.$ac_ext, and return whether this succeeded.
1569 + ac_fn_fc_try_compile ()
1570 + {
1571 +  as_lineno=${as_lineno-"$1"} as_lineno_stack=as_lineno_stack=$as_lineno_stack
1572 +  rm -f conftest.$ac_objext
1573 +  if { { ac_try="$ac_compile"
1574 + case "(($ac_try" in
1575 +  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
1576 +  *) ac_try_echo=$ac_try;;
1577 + esac
1578 + eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
1579 + $as_echo "$ac_try_echo"; } >&5
1580 +  (eval "$ac_compile") 2>conftest.err
1581 +  ac_status=$?
1582 +  if test -s conftest.err; then
1583 +    grep -v '^ *+' conftest.err >conftest.er1
1584 +    cat conftest.er1 >&5
1585 +    mv -f conftest.er1 conftest.err
1586 +  fi
1587 +  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
1588 +  test $ac_status = 0; } && {
1589 +         test -z "$ac_fc_werror_flag" ||
1590 +         test ! -s conftest.err
1591 +       } && test -s conftest.$ac_objext; then :
1592 +  ac_retval=0
1593 + else
1594 +  $as_echo "$as_me: failed program was:" >&5
1595 + sed 's/^/| /' conftest.$ac_ext >&5
1596 +
1597 +        ac_retval=1
1598 + fi
1599 +  eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1600 +  as_fn_set_status $ac_retval
1601 +
1602 + } # ac_fn_fc_try_compile
1603 +
1604   # ac_fn_cxx_try_link LINENO
1605   # -------------------------
1606   # Try to link conftest.$ac_ext, and return whether this succeeded.
# Line 1578 | Line 1643 | fi
1643    # left behind by Apple's compiler.  We do this before executing the actions.
1644    rm -rf conftest.dSYM conftest_ipa8_conftest.oo
1645    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1646 <  return $ac_retval
1646 >  as_fn_set_status $ac_retval
1647  
1648   } # ac_fn_cxx_try_link
1649  
# Line 1648 | Line 1713 | $as_echo "$ac_res" >&6; }
1713    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1714  
1715   } # ac_fn_cxx_check_func
1651
1652 # ac_fn_c_try_compile LINENO
1653 # --------------------------
1654 # Try to compile conftest.$ac_ext, and return whether this succeeded.
1655 ac_fn_c_try_compile ()
1656 {
1657  as_lineno=${as_lineno-"$1"} as_lineno_stack=as_lineno_stack=$as_lineno_stack
1658  rm -f conftest.$ac_objext
1659  if { { ac_try="$ac_compile"
1660 case "(($ac_try" in
1661  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
1662  *) ac_try_echo=$ac_try;;
1663 esac
1664 eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
1665 $as_echo "$ac_try_echo"; } >&5
1666  (eval "$ac_compile") 2>conftest.err
1667  ac_status=$?
1668  if test -s conftest.err; then
1669    grep -v '^ *+' conftest.err >conftest.er1
1670    cat conftest.er1 >&5
1671    mv -f conftest.er1 conftest.err
1672  fi
1673  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
1674  test $ac_status = 0; } && {
1675         test -z "$ac_c_werror_flag" ||
1676         test ! -s conftest.err
1677       } && test -s conftest.$ac_objext; then :
1678  ac_retval=0
1679 else
1680  $as_echo "$as_me: failed program was:" >&5
1681 sed 's/^/| /' conftest.$ac_ext >&5
1682
1683        ac_retval=1
1684 fi
1685  eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1686  return $ac_retval
1687
1688 } # ac_fn_c_try_compile
1716  
1717   # ac_fn_c_try_link LINENO
1718   # -----------------------
# Line 1729 | Line 1756 | fi
1756    # left behind by Apple's compiler.  We do this before executing the actions.
1757    rm -rf conftest.dSYM conftest_ipa8_conftest.oo
1758    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1759 <  return $ac_retval
1759 >  as_fn_set_status $ac_retval
1760  
1761   } # ac_fn_c_try_link
1762  
# Line 1799 | Line 1826 | $as_echo "$ac_res" >&6; }
1826    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1827  
1828   } # ac_fn_c_check_func
1802
1803 # ac_fn_fc_try_compile LINENO
1804 # ---------------------------
1805 # Try to compile conftest.$ac_ext, and return whether this succeeded.
1806 ac_fn_fc_try_compile ()
1807 {
1808  as_lineno=${as_lineno-"$1"} as_lineno_stack=as_lineno_stack=$as_lineno_stack
1809  rm -f conftest.$ac_objext
1810  if { { ac_try="$ac_compile"
1811 case "(($ac_try" in
1812  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
1813  *) ac_try_echo=$ac_try;;
1814 esac
1815 eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
1816 $as_echo "$ac_try_echo"; } >&5
1817  (eval "$ac_compile") 2>conftest.err
1818  ac_status=$?
1819  if test -s conftest.err; then
1820    grep -v '^ *+' conftest.err >conftest.er1
1821    cat conftest.er1 >&5
1822    mv -f conftest.er1 conftest.err
1823  fi
1824  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
1825  test $ac_status = 0; } && {
1826         test -z "$ac_fc_werror_flag" ||
1827         test ! -s conftest.err
1828       } && test -s conftest.$ac_objext; then :
1829  ac_retval=0
1830 else
1831  $as_echo "$as_me: failed program was:" >&5
1832 sed 's/^/| /' conftest.$ac_ext >&5
1829  
1834        ac_retval=1
1835 fi
1836  eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1837  return $ac_retval
1838
1839 } # ac_fn_fc_try_compile
1840
1830   # ac_fn_fc_try_link LINENO
1831   # ------------------------
1832   # Try to link conftest.$ac_ext, and return whether this succeeded.
# Line 1880 | Line 1869 | fi
1869    # left behind by Apple's compiler.  We do this before executing the actions.
1870    rm -rf conftest.dSYM conftest_ipa8_conftest.oo
1871    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1872 <  return $ac_retval
1872 >  as_fn_set_status $ac_retval
1873  
1874   } # ac_fn_fc_try_link
1875  
# Line 1917 | Line 1906 | fi
1906      ac_retval=1
1907   fi
1908    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
1909 <  return $ac_retval
1909 >  as_fn_set_status $ac_retval
1910  
1911   } # ac_fn_c_try_cpp
1912  
# Line 2052 | Line 2041 | fi
2041   fi
2042    rm -rf conftest.dSYM conftest_ipa8_conftest.oo
2043    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
2044 <  return $ac_retval
2044 >  as_fn_set_status $ac_retval
2045  
2046   } # ac_fn_c_try_run
2047  
# Line 2120 | Line 2109 | fi
2109      ac_retval=1
2110   fi
2111    eval $as_lineno_stack; test "x$as_lineno_stack" = x && { as_lineno=; unset as_lineno;}
2112 <  return $ac_retval
2112 >  as_fn_set_status $ac_retval
2113  
2114   } # ac_fn_cxx_try_cpp
2115  
# Line 2290 | Line 2279 | running configure, to aid debugging if configure makes
2279   This file contains any messages produced by compilers while
2280   running configure, to aid debugging if configure makes a mistake.
2281  
2282 < It was created by OOPSE $as_me 4.0, which was
2283 < generated by GNU Autoconf 2.64.  Invocation command line was
2282 > It was created by OpenMD $as_me 1.0, which was
2283 > generated by GNU Autoconf 2.65.  Invocation command line was
2284  
2285    $ $0 $@
2286  
# Line 2544 | Line 2533 | do
2533   for ac_site_file in "$ac_site_file1" "$ac_site_file2"
2534   do
2535    test "x$ac_site_file" = xNONE && continue
2536 <  if test -r "$ac_site_file"; then
2536 >  if test /dev/null != "$ac_site_file" && test -r "$ac_site_file"; then
2537      { $as_echo "$as_me:${as_lineno-$LINENO}: loading site script $ac_site_file" >&5
2538   $as_echo "$as_me: loading site script $ac_site_file" >&6;}
2539      sed 's/^/| /' "$ac_site_file" >&5
# Line 2553 | Line 2542 | if test -r "$cache_file"; then
2542   done
2543  
2544   if test -r "$cache_file"; then
2545 <  # Some versions of bash will fail to source /dev/null (special
2546 <  # files actually), so we avoid doing that.
2547 <  if test -f "$cache_file"; then
2545 >  # Some versions of bash will fail to source /dev/null (special files
2546 >  # actually), so we avoid doing that.  DJGPP emulates it as a regular file.
2547 >  if test /dev/null != "$cache_file" && test -f "$cache_file"; then
2548      { $as_echo "$as_me:${as_lineno-$LINENO}: loading cache $cache_file" >&5
2549   $as_echo "$as_me: loading cache $cache_file" >&6;}
2550      case $cache_file in
# Line 2902 | Line 2891 | ac_config_headers="$ac_config_headers src/config.h"
2891  
2892  
2893  
2905
2906
2907
2908
2909
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2912
2913
2914
2915
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2920
2921
2922
2923
2924
2925
2926 # This is taken from http://autoqt.sourceforge.net/
2927 # Copyright (c) 2002, Geoffrey Wossum
2928 # All rights reserved.
2929
2930 # Redistribution and use in source and binary forms, with or without
2931 # modification, are permitted provided that the following conditions are
2932 # met:
2933
2934 #  - Redistributions of source code must retain the above copyright notice,
2935 #    this list of conditions and the following disclaimer.
2936
2937 #  - Redistributions in binary form must reproduce the above copyright
2938 #    notice, this list of conditions and the following disclaimer in the
2939 #    documentation and/or other materials provided with the distribution.
2940
2941 #  - Neither the name of Geoffrey Wossum nor the names of its
2942 #    contributors may be used to endorse or promote products derived from
2943 #    this software without specific prior written permission.
2944
2945
2946 # THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS
2947 # "AS IS" AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED
2948 # TO, THE IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR
2949 # PURPOSE ARE DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT OWNER OR
2950 # CONTRIBUTORS BE LIABLE FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL,
2951 # EXEMPLARY, OR CONSEQUENTIAL DAMAGES (INCLUDING, BUT NOT LIMITED TO,
2952 # PROCUREMENT OF SUBSTITUTE GOODS OR SERVICES; LOSS OF USE, DATA, OR PROFITS;
2953 # OR BUSINESS INTERRUPTION) HOWEVER CAUSED AND ON ANY THEORY OF LIABILITY,
2954 # WHETHER IN CONTRACT, STRICT LIABILITY, OR TORT (INCLUDING NEGLIGENCE OR
2955 # OTHERWISE) ARISING IN ANY WAY OUT OF THE USE OF THIS SOFTWARE, EVEN IF
2956 # ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
2957
2958
2959 # Check for Qt compiler flags, linker flags, and binary packages
2960
2961
2962
2894   # who am i
2895   # Make sure we can run config.sub.
2896   $SHELL "$ac_aux_dir/config.sub" sun4 >/dev/null 2>&1 ||
# Line 3036 | Line 2967 | case $host_os in *\ *) host_os=`echo "$host_os" | sed
2967  
2968  
2969   # set program name
2970 < PROGNAME="oopse"
2970 > PROGNAME="openmd"
2971  
2972  
2973  
2974  
2975   OBJEXT=".$OBJEXT"
2976  
2977 < OOPSE=oopse
2977 > OPENMD=openmd
2978  
2979   if test "x${prefix}" = "xNONE"
2980   then
2981 <  OOPSE_HOME=${ac_default_prefix}/oopse
2981 >  OPENMD_HOME=${ac_default_prefix}/openmd
2982   else
2983 <  OOPSE_HOME=${prefix}/oopse
2983 >  OPENMD_HOME=${prefix}/openmd
2984   fi
2985 < # Check whether --enable-oopse-home was given.
2986 < if test "${enable_oopse_home+set}" = set; then :
2987 <  enableval=$enable_oopse_home; OOPSE_HOME="${enableval}"
2985 > # Check whether --enable-openmd-home was given.
2986 > if test "${enable_openmd_home+set}" = set; then :
2987 >  enableval=$enable_openmd_home; OPENMD_HOME="${enableval}"
2988   fi
2989  
2990  
# Line 3094 | Line 3025 | fi
3025  
3026   fi
3027  
3097 if test x"$CC" != x; then
3098   for ac_prog in $CC
3099 do
3100  # Extract the first word of "$ac_prog", so it can be a program name with args.
3101 set dummy $ac_prog; ac_word=$2
3102 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
3103 $as_echo_n "checking for $ac_word... " >&6; }
3104 if test "${ac_cv_prog_ac_cc_set+set}" = set; then :
3105  $as_echo_n "(cached) " >&6
3106 else
3107  if test -n "$ac_cc_set"; then
3108  ac_cv_prog_ac_cc_set="$ac_cc_set" # Let the user override the test.
3109 else
3110 as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
3111 for as_dir in $PATH
3112 do
3113  IFS=$as_save_IFS
3114  test -z "$as_dir" && as_dir=.
3115    for ac_exec_ext in '' $ac_executable_extensions; do
3116  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
3117    ac_cv_prog_ac_cc_set="$ac_prog"
3118    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
3119    break 2
3120  fi
3121 done
3122  done
3123 IFS=$as_save_IFS
3124
3125 fi
3126 fi
3127 ac_cc_set=$ac_cv_prog_ac_cc_set
3128 if test -n "$ac_cc_set"; then
3129  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cc_set" >&5
3130 $as_echo "$ac_cc_set" >&6; }
3131 else
3132  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
3133 $as_echo "no" >&6; }
3134 fi
3135
3136
3137  test -n "$ac_cc_set" && break
3138 done
3139 test -n "$ac_cc_set" || ac_cc_set="no"
3140
3141   if test $ac_cc_set != no; then :
3142
3143     # Extract the first word of "$ac_cc_set", so it can be a program name with args.
3144 set dummy $ac_cc_set; ac_word=$2
3145 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
3146 $as_echo_n "checking for $ac_word... " >&6; }
3147 if test "${ac_cv_path_ac_cc_path+set}" = set; then :
3148  $as_echo_n "(cached) " >&6
3149 else
3150  case $ac_cc_path in
3151  [\\/]* | ?:[\\/]*)
3152  ac_cv_path_ac_cc_path="$ac_cc_path" # Let the user override the test with a path.
3153  ;;
3154  *)
3155  as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
3156 for as_dir in $PATH
3157 do
3158  IFS=$as_save_IFS
3159  test -z "$as_dir" && as_dir=.
3160    for ac_exec_ext in '' $ac_executable_extensions; do
3161  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
3162    ac_cv_path_ac_cc_path="$as_dir/$ac_word$ac_exec_ext"
3163    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
3164    break 2
3165  fi
3166 done
3167  done
3168 IFS=$as_save_IFS
3169
3170  test -z "$ac_cv_path_ac_cc_path" && ac_cv_path_ac_cc_path="no"
3171  ;;
3172 esac
3173 fi
3174 ac_cc_path=$ac_cv_path_ac_cc_path
3175 if test -n "$ac_cc_path"; then
3176  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cc_path" >&5
3177 $as_echo "$ac_cc_path" >&6; }
3178 else
3179  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
3180 $as_echo "no" >&6; }
3181 fi
3182
3183
3184 else
3185
3186     as_fn_error "Specified C compiler $CC doesn't seem to exist!" "$LINENO" 5
3187 fi
3188
3189   if test $ac_cc_path != no; then :
3190
3191     { $as_echo "$as_me:${as_lineno-$LINENO}: Will attempt to use $CC as C compiler" >&5
3192 $as_echo "$as_me: Will attempt to use $CC as C compiler" >&6;}
3193     MPICC=$CC
3194
3195 else
3196
3197     as_fn_error "Can't find path to user-specified C compiler $CC" "$LINENO" 5
3198 fi
3199 fi
3200
3201 if test x"$CXX" != x; then
3202   for ac_prog in $CXX
3203 do
3204  # Extract the first word of "$ac_prog", so it can be a program name with args.
3205 set dummy $ac_prog; ac_word=$2
3206 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
3207 $as_echo_n "checking for $ac_word... " >&6; }
3208 if test "${ac_cv_prog_ac_cxx_set+set}" = set; then :
3209  $as_echo_n "(cached) " >&6
3210 else
3211  if test -n "$ac_cxx_set"; then
3212  ac_cv_prog_ac_cxx_set="$ac_cxx_set" # Let the user override the test.
3213 else
3214 as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
3215 for as_dir in $PATH
3216 do
3217  IFS=$as_save_IFS
3218  test -z "$as_dir" && as_dir=.
3219    for ac_exec_ext in '' $ac_executable_extensions; do
3220  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
3221    ac_cv_prog_ac_cxx_set="$ac_prog"
3222    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
3223    break 2
3224  fi
3225 done
3226  done
3227 IFS=$as_save_IFS
3228
3229 fi
3230 fi
3231 ac_cxx_set=$ac_cv_prog_ac_cxx_set
3232 if test -n "$ac_cxx_set"; then
3233  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cxx_set" >&5
3234 $as_echo "$ac_cxx_set" >&6; }
3235 else
3236  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
3237 $as_echo "no" >&6; }
3238 fi
3239
3240
3241  test -n "$ac_cxx_set" && break
3242 done
3243 test -n "$ac_cxx_set" || ac_cxx_set="no"
3244
3245   if test $ac_cxx_set != no; then :
3246
3247     # Extract the first word of "$ac_cxx_set", so it can be a program name with args.
3248 set dummy $ac_cxx_set; ac_word=$2
3249 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
3250 $as_echo_n "checking for $ac_word... " >&6; }
3251 if test "${ac_cv_path_ac_cxx_path+set}" = set; then :
3252  $as_echo_n "(cached) " >&6
3253 else
3254  case $ac_cxx_path in
3255  [\\/]* | ?:[\\/]*)
3256  ac_cv_path_ac_cxx_path="$ac_cxx_path" # Let the user override the test with a path.
3257  ;;
3258  *)
3259  as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
3260 for as_dir in $PATH
3261 do
3262  IFS=$as_save_IFS
3263  test -z "$as_dir" && as_dir=.
3264    for ac_exec_ext in '' $ac_executable_extensions; do
3265  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
3266    ac_cv_path_ac_cxx_path="$as_dir/$ac_word$ac_exec_ext"
3267    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
3268    break 2
3269  fi
3270 done
3271  done
3272 IFS=$as_save_IFS
3273
3274  test -z "$ac_cv_path_ac_cxx_path" && ac_cv_path_ac_cxx_path="no"
3275  ;;
3276 esac
3277 fi
3278 ac_cxx_path=$ac_cv_path_ac_cxx_path
3279 if test -n "$ac_cxx_path"; then
3280  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cxx_path" >&5
3281 $as_echo "$ac_cxx_path" >&6; }
3282 else
3283  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
3284 $as_echo "no" >&6; }
3285 fi
3286
3287
3288 else
3289
3290     as_fn_error "Specified C++ compiler $CXX doesn't seem to exist!" "$LINENO" 5
3291 fi
3292
3293   if test $ac_cxx_path != no; then :
3294
3295     { $as_echo "$as_me:${as_lineno-$LINENO}: Will attempt to use $CXX as C++ compiler" >&5
3296 $as_echo "$as_me: Will attempt to use $CXX as C++ compiler" >&6;}
3297     MPICXX=$CXX
3298
3299 else
3300
3301     as_fn_error "Can't find path to user-specified C++ compiler $CXX" "$LINENO" 5
3302 fi
3303 fi
3304
3305 if test x"$FC" != x; then
3306   for ac_prog in $FC
3307 do
3308  # Extract the first word of "$ac_prog", so it can be a program name with args.
3309 set dummy $ac_prog; ac_word=$2
3310 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
3311 $as_echo_n "checking for $ac_word... " >&6; }
3312 if test "${ac_cv_prog_ac_fc_set+set}" = set; then :
3313  $as_echo_n "(cached) " >&6
3314 else
3315  if test -n "$ac_fc_set"; then
3316  ac_cv_prog_ac_fc_set="$ac_fc_set" # Let the user override the test.
3317 else
3318 as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
3319 for as_dir in $PATH
3320 do
3321  IFS=$as_save_IFS
3322  test -z "$as_dir" && as_dir=.
3323    for ac_exec_ext in '' $ac_executable_extensions; do
3324  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
3325    ac_cv_prog_ac_fc_set="$ac_prog"
3326    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
3327    break 2
3328  fi
3329 done
3330  done
3331 IFS=$as_save_IFS
3332
3333 fi
3334 fi
3335 ac_fc_set=$ac_cv_prog_ac_fc_set
3336 if test -n "$ac_fc_set"; then
3337  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_fc_set" >&5
3338 $as_echo "$ac_fc_set" >&6; }
3339 else
3340  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
3341 $as_echo "no" >&6; }
3342 fi
3343
3344
3345  test -n "$ac_fc_set" && break
3346 done
3347 test -n "$ac_fc_set" || ac_fc_set="no"
3348
3349   if test $ac_fc_set != no; then :
3350
3351     # Extract the first word of "$ac_fc_set", so it can be a program name with args.
3352 set dummy $ac_fc_set; ac_word=$2
3353 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
3354 $as_echo_n "checking for $ac_word... " >&6; }
3355 if test "${ac_cv_path_ac_fc_path+set}" = set; then :
3356  $as_echo_n "(cached) " >&6
3357 else
3358  case $ac_fc_path in
3359  [\\/]* | ?:[\\/]*)
3360  ac_cv_path_ac_fc_path="$ac_fc_path" # Let the user override the test with a path.
3361  ;;
3362  *)
3363  as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
3364 for as_dir in $PATH
3365 do
3366  IFS=$as_save_IFS
3367  test -z "$as_dir" && as_dir=.
3368    for ac_exec_ext in '' $ac_executable_extensions; do
3369  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
3370    ac_cv_path_ac_fc_path="$as_dir/$ac_word$ac_exec_ext"
3371    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
3372    break 2
3373  fi
3374 done
3375  done
3376 IFS=$as_save_IFS
3377
3378  test -z "$ac_cv_path_ac_fc_path" && ac_cv_path_ac_fc_path="no"
3379  ;;
3380 esac
3381 fi
3382 ac_fc_path=$ac_cv_path_ac_fc_path
3383 if test -n "$ac_fc_path"; then
3384  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_fc_path" >&5
3385 $as_echo "$ac_fc_path" >&6; }
3386 else
3387  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
3388 $as_echo "no" >&6; }
3389 fi
3390
3391
3392 else
3393
3394     as_fn_error "Specified Fortran compiler $FC doesn't seem to exist!" "$LINENO" 5
3395 fi
3396
3397   if test $ac_fc_path != no; then :
3398
3399     { $as_echo "$as_me:${as_lineno-$LINENO}: Will attempt to use $FC as Fortran compiler" >&5
3400 $as_echo "$as_me: Will attempt to use $FC as Fortran compiler" >&6;}
3401     MPIFC=$FC
3402
3403 else
3404
3405     as_fn_error "Can't find path to user-specified Fortran compiler $FC" "$LINENO" 5
3406 fi
3407 fi
3408
3409
3028   ac_ext=cpp
3029   ac_cpp='$CXXCPP $CPPFLAGS'
3030   ac_compile='$CXX -c $CXXFLAGS $CPPFLAGS conftest.$ac_ext >&5'
3031   ac_link='$CXX -o conftest$ac_exeext $CXXFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
3032   ac_compiler_gnu=$ac_cv_cxx_compiler_gnu
3415
3416 ac_ext=cpp
3417 ac_cpp='$CXXCPP $CPPFLAGS'
3418 ac_compile='$CXX -c $CXXFLAGS $CPPFLAGS conftest.$ac_ext >&5'
3419 ac_link='$CXX -o conftest$ac_exeext $CXXFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
3420 ac_compiler_gnu=$ac_cv_cxx_compiler_gnu
3033   if test -z "$CXX"; then
3034    if test -n "$CCC"; then
3035      CXX=$CCC
3036    else
3037      if test -n "$ac_tool_prefix"; then
3038 <  for ac_prog in g++ c++ gpp aCC CC cxx cc++ cl.exe FCC KCC RCC xlC_r xlC
3038 >  for ac_prog in $CXX icpc pathCC pgCC c++ xlc++ xlC g++ CC
3039    do
3040      # Extract the first word of "$ac_tool_prefix$ac_prog", so it can be a program name with args.
3041   set dummy $ac_tool_prefix$ac_prog; ac_word=$2
# Line 3467 | Line 3079 | if test -z "$CXX"; then
3079   fi
3080   if test -z "$CXX"; then
3081    ac_ct_CXX=$CXX
3082 <  for ac_prog in g++ c++ gpp aCC CC cxx cc++ cl.exe FCC KCC RCC xlC_r xlC
3082 >  for ac_prog in $CXX icpc pathCC pgCC c++ xlc++ xlC g++ CC
3083   do
3084    # Extract the first word of "$ac_prog", so it can be a program name with args.
3085   set dummy $ac_prog; ac_word=$2
# Line 3543 | Line 3155 | $as_echo "$ac_try_echo"; } >&5
3155   ... rest of stderr output deleted ...
3156           10q' conftest.err >conftest.er1
3157      cat conftest.er1 >&5
3546    rm -f conftest.er1 conftest.err
3158    fi
3159 +  rm -f conftest.er1 conftest.err
3160    $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
3161    test $ac_status = 0; }
3162   done
3163  
3164   cat confdefs.h - <<_ACEOF >conftest.$ac_ext
3165   /* end confdefs.h.  */
3166 < #include <stdio.h>
3166 >
3167   int
3168   main ()
3169   {
3558 FILE *f = fopen ("conftest.out", "w");
3559 return ferror (f) || fclose (f) != 0;
3170  
3171    ;
3172    return 0;
3173   }
3174   _ACEOF
3175   ac_clean_files_save=$ac_clean_files
3176 < ac_clean_files="$ac_clean_files a.out a.out.dSYM a.exe b.out conftest.out"
3176 > ac_clean_files="$ac_clean_files a.out a.out.dSYM a.exe b.out"
3177   # Try to create an executable without -o first, disregard a.out.
3178   # It will help us diagnose broken compilers, and finding out an intuition
3179   # of exeext.
3180 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking for C++ compiler default output file name" >&5
3181 < $as_echo_n "checking for C++ compiler default output file name... " >&6; }
3180 > { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether the C++ compiler works" >&5
3181 > $as_echo_n "checking whether the C++ compiler works... " >&6; }
3182   ac_link_default=`$as_echo "$ac_link" | sed 's/ -o *conftest[^ ]*//'`
3183  
3184   # The possible output files:
# Line 3630 | Line 3240 | fi
3240   else
3241    ac_file=''
3242   fi
3633 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_file" >&5
3634 $as_echo "$ac_file" >&6; }
3243   if test -z "$ac_file"; then :
3244 <  $as_echo "$as_me: failed program was:" >&5
3244 >  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
3245 > $as_echo "no" >&6; }
3246 > $as_echo "$as_me: failed program was:" >&5
3247   sed 's/^/| /' conftest.$ac_ext >&5
3248  
3249   { { $as_echo "$as_me:${as_lineno-$LINENO}: error: in \`$ac_pwd':" >&5
# Line 3641 | Line 3251 | See \`config.log' for more details." "$LINENO" 5; }; }
3251   { as_fn_set_status 77
3252   as_fn_error "C++ compiler cannot create executables
3253   See \`config.log' for more details." "$LINENO" 5; }; }
3254 + else
3255 +  { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
3256 + $as_echo "yes" >&6; }
3257   fi
3258 + { $as_echo "$as_me:${as_lineno-$LINENO}: checking for C++ compiler default output file name" >&5
3259 + $as_echo_n "checking for C++ compiler default output file name... " >&6; }
3260 + { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_file" >&5
3261 + $as_echo "$ac_file" >&6; }
3262   ac_exeext=$ac_cv_exeext
3263  
3264 < # Check that the compiler produces executables we can run.  If not, either
3648 < # the compiler is broken, or we cross compile.
3649 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether the C++ compiler works" >&5
3650 < $as_echo_n "checking whether the C++ compiler works... " >&6; }
3651 < # If not cross compiling, check that we can run a simple program.
3652 < if test "$cross_compiling" != yes; then
3653 <  if { ac_try='./$ac_file'
3654 <  { { case "(($ac_try" in
3655 <  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
3656 <  *) ac_try_echo=$ac_try;;
3657 < esac
3658 < eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
3659 < $as_echo "$ac_try_echo"; } >&5
3660 <  (eval "$ac_try") 2>&5
3661 <  ac_status=$?
3662 <  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
3663 <  test $ac_status = 0; }; }; then
3664 <    cross_compiling=no
3665 <  else
3666 <    if test "$cross_compiling" = maybe; then
3667 <        cross_compiling=yes
3668 <    else
3669 <        { { $as_echo "$as_me:${as_lineno-$LINENO}: error: in \`$ac_pwd':" >&5
3670 < $as_echo "$as_me: error: in \`$ac_pwd':" >&2;}
3671 < as_fn_error "cannot run C++ compiled programs.
3672 < If you meant to cross compile, use \`--host'.
3673 < See \`config.log' for more details." "$LINENO" 5; }
3674 <    fi
3675 <  fi
3676 < fi
3677 < { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
3678 < $as_echo "yes" >&6; }
3679 <
3680 < rm -f -r a.out a.out.dSYM a.exe conftest$ac_cv_exeext b.out conftest.out
3264 > rm -f -r a.out a.out.dSYM a.exe conftest$ac_cv_exeext b.out
3265   ac_clean_files=$ac_clean_files_save
3682 # Check that the compiler produces executables we can run.  If not, either
3683 # the compiler is broken, or we cross compile.
3684 { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether we are cross compiling" >&5
3685 $as_echo_n "checking whether we are cross compiling... " >&6; }
3686 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $cross_compiling" >&5
3687 $as_echo "$cross_compiling" >&6; }
3688
3266   { $as_echo "$as_me:${as_lineno-$LINENO}: checking for suffix of executables" >&5
3267   $as_echo_n "checking for suffix of executables... " >&6; }
3268   if { { ac_try="$ac_link"
# Line 3718 | Line 3295 | fi
3295   as_fn_error "cannot compute suffix of executables: cannot compile and link
3296   See \`config.log' for more details." "$LINENO" 5; }
3297   fi
3298 < rm -f conftest$ac_cv_exeext
3298 > rm -f conftest conftest$ac_cv_exeext
3299   { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_exeext" >&5
3300   $as_echo "$ac_cv_exeext" >&6; }
3301  
3302   rm -f conftest.$ac_ext
3303   EXEEXT=$ac_cv_exeext
3304   ac_exeext=$EXEEXT
3305 + cat confdefs.h - <<_ACEOF >conftest.$ac_ext
3306 + /* end confdefs.h.  */
3307 + #include <stdio.h>
3308 + int
3309 + main ()
3310 + {
3311 + FILE *f = fopen ("conftest.out", "w");
3312 + return ferror (f) || fclose (f) != 0;
3313 +
3314 +  ;
3315 +  return 0;
3316 + }
3317 + _ACEOF
3318 + ac_clean_files="$ac_clean_files conftest.out"
3319 + # Check that the compiler produces executables we can run.  If not, either
3320 + # the compiler is broken, or we cross compile.
3321 + { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether we are cross compiling" >&5
3322 + $as_echo_n "checking whether we are cross compiling... " >&6; }
3323 + if test "$cross_compiling" != yes; then
3324 +  { { ac_try="$ac_link"
3325 + case "(($ac_try" in
3326 +  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
3327 +  *) ac_try_echo=$ac_try;;
3328 + esac
3329 + eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
3330 + $as_echo "$ac_try_echo"; } >&5
3331 +  (eval "$ac_link") 2>&5
3332 +  ac_status=$?
3333 +  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
3334 +  test $ac_status = 0; }
3335 +  if { ac_try='./conftest$ac_cv_exeext'
3336 +  { { case "(($ac_try" in
3337 +  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
3338 +  *) ac_try_echo=$ac_try;;
3339 + esac
3340 + eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
3341 + $as_echo "$ac_try_echo"; } >&5
3342 +  (eval "$ac_try") 2>&5
3343 +  ac_status=$?
3344 +  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
3345 +  test $ac_status = 0; }; }; then
3346 +    cross_compiling=no
3347 +  else
3348 +    if test "$cross_compiling" = maybe; then
3349 +        cross_compiling=yes
3350 +    else
3351 +        { { $as_echo "$as_me:${as_lineno-$LINENO}: error: in \`$ac_pwd':" >&5
3352 + $as_echo "$as_me: error: in \`$ac_pwd':" >&2;}
3353 + as_fn_error "cannot run C++ compiled programs.
3354 + If you meant to cross compile, use \`--host'.
3355 + See \`config.log' for more details." "$LINENO" 5; }
3356 +    fi
3357 +  fi
3358 + fi
3359 + { $as_echo "$as_me:${as_lineno-$LINENO}: result: $cross_compiling" >&5
3360 + $as_echo "$cross_compiling" >&6; }
3361 +
3362 + rm -f conftest.$ac_ext conftest$ac_cv_exeext conftest.out
3363 + ac_clean_files=$ac_clean_files_save
3364   { $as_echo "$as_me:${as_lineno-$LINENO}: checking for suffix of object files" >&5
3365   $as_echo_n "checking for suffix of object files... " >&6; }
3366   if test "${ac_cv_objext+set}" = set; then :
# Line 3891 | Line 3527 | fi
3527      CXXFLAGS=
3528    fi
3529   fi
3530 < ac_ext=cpp
3531 < ac_cpp='$CXXCPP $CPPFLAGS'
3532 < ac_compile='$CXX -c $CXXFLAGS $CPPFLAGS conftest.$ac_ext >&5'
3533 < ac_link='$CXX -o conftest$ac_exeext $CXXFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
3534 < ac_compiler_gnu=$ac_cv_cxx_compiler_gnu
3899 <
3900 <
3901 <
3902 <
3903 <
3904 <
3905 <
3906 <        for ac_prog in openmpicxx openmpiCC openmpic++ mpic++ mpicxx mpiCC hcp mpxlC_r mpxlC mpCC cmpic++
3907 < do
3908 <  # Extract the first word of "$ac_prog", so it can be a program name with args.
3909 < set dummy $ac_prog; ac_word=$2
3910 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
3911 < $as_echo_n "checking for $ac_word... " >&6; }
3912 < if test "${ac_cv_prog_MPICXX+set}" = set; then :
3913 <  $as_echo_n "(cached) " >&6
3914 < else
3915 <  if test -n "$MPICXX"; then
3916 <  ac_cv_prog_MPICXX="$MPICXX" # Let the user override the test.
3917 < else
3918 < as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
3919 < for as_dir in $PATH
3920 < do
3921 <  IFS=$as_save_IFS
3922 <  test -z "$as_dir" && as_dir=.
3923 <    for ac_exec_ext in '' $ac_executable_extensions; do
3924 <  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
3925 <    ac_cv_prog_MPICXX="$ac_prog"
3926 <    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
3927 <    break 2
3928 <  fi
3929 < done
3930 <  done
3931 < IFS=$as_save_IFS
3932 <
3933 < fi
3934 < fi
3935 < MPICXX=$ac_cv_prog_MPICXX
3936 < if test -n "$MPICXX"; then
3937 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $MPICXX" >&5
3938 < $as_echo "$MPICXX" >&6; }
3939 < else
3940 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
3941 < $as_echo "no" >&6; }
3942 < fi
3943 <
3944 <
3945 <  test -n "$MPICXX" && break
3946 < done
3947 < test -n "$MPICXX" || MPICXX="$CXX"
3948 <
3949 <        ax_mpi_save_CXX="$CXX"
3950 <        CXX="$MPICXX"
3951 <
3952 <
3953 <
3954 < if test x = x"$MPILIBS"; then
3955 <        ac_fn_cxx_check_func "$LINENO" "MPI_Init" "ac_cv_func_MPI_Init"
3956 < if test "x$ac_cv_func_MPI_Init" = x""yes; then :
3957 <  MPILIBS=" "
3958 < fi
3959 <
3960 < fi
3961 <
3962 < if test x = x"$MPILIBS"; then
3963 <        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpi" >&5
3964 < $as_echo_n "checking for MPI_Init in -lmpi... " >&6; }
3965 < if test "${ac_cv_lib_mpi_MPI_Init+set}" = set; then :
3966 <  $as_echo_n "(cached) " >&6
3967 < else
3968 <  ac_check_lib_save_LIBS=$LIBS
3969 < LIBS="-lmpi  $LIBS"
3970 < cat confdefs.h - <<_ACEOF >conftest.$ac_ext
3971 < /* end confdefs.h.  */
3972 <
3973 < /* Override any GCC internal prototype to avoid an error.
3974 <   Use char because int might match the return type of a GCC
3975 <   builtin and then its argument prototype would still apply.  */
3976 < #ifdef __cplusplus
3977 < extern "C"
3978 < #endif
3979 < char MPI_Init ();
3980 < int
3981 < main ()
3982 < {
3983 < return MPI_Init ();
3984 <  ;
3985 <  return 0;
3986 < }
3987 < _ACEOF
3988 < if ac_fn_cxx_try_link "$LINENO"; then :
3989 <  ac_cv_lib_mpi_MPI_Init=yes
3990 < else
3991 <  ac_cv_lib_mpi_MPI_Init=no
3992 < fi
3993 < rm -f core conftest.err conftest.$ac_objext \
3994 <    conftest$ac_exeext conftest.$ac_ext
3995 < LIBS=$ac_check_lib_save_LIBS
3996 < fi
3997 < { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpi_MPI_Init" >&5
3998 < $as_echo "$ac_cv_lib_mpi_MPI_Init" >&6; }
3999 < if test "x$ac_cv_lib_mpi_MPI_Init" = x""yes; then :
4000 <  MPILIBS="-lmpi"
4001 < fi
4002 <
4003 < fi
4004 < if test x = x"$MPILIBS"; then
4005 <        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpich" >&5
4006 < $as_echo_n "checking for MPI_Init in -lmpich... " >&6; }
4007 < if test "${ac_cv_lib_mpich_MPI_Init+set}" = set; then :
4008 <  $as_echo_n "(cached) " >&6
4009 < else
4010 <  ac_check_lib_save_LIBS=$LIBS
4011 < LIBS="-lmpich  $LIBS"
4012 < cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4013 < /* end confdefs.h.  */
3530 > ac_ext=c
3531 > ac_cpp='$CPP $CPPFLAGS'
3532 > ac_compile='$CC -c $CFLAGS $CPPFLAGS conftest.$ac_ext >&5'
3533 > ac_link='$CC -o conftest$ac_exeext $CFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
3534 > ac_compiler_gnu=$ac_cv_c_compiler_gnu
3535  
4015 /* Override any GCC internal prototype to avoid an error.
4016   Use char because int might match the return type of a GCC
4017   builtin and then its argument prototype would still apply.  */
4018 #ifdef __cplusplus
4019 extern "C"
4020 #endif
4021 char MPI_Init ();
4022 int
4023 main ()
4024 {
4025 return MPI_Init ();
4026  ;
4027  return 0;
4028 }
4029 _ACEOF
4030 if ac_fn_cxx_try_link "$LINENO"; then :
4031  ac_cv_lib_mpich_MPI_Init=yes
4032 else
4033  ac_cv_lib_mpich_MPI_Init=no
4034 fi
4035 rm -f core conftest.err conftest.$ac_objext \
4036    conftest$ac_exeext conftest.$ac_ext
4037 LIBS=$ac_check_lib_save_LIBS
4038 fi
4039 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpich_MPI_Init" >&5
4040 $as_echo "$ac_cv_lib_mpich_MPI_Init" >&6; }
4041 if test "x$ac_cv_lib_mpich_MPI_Init" = x""yes; then :
4042  MPILIBS="-lmpich"
4043 fi
4044
4045 fi
4046
4047 if test x != x"$MPILIBS"; then
4048        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for mpi.h" >&5
4049 $as_echo_n "checking for mpi.h... " >&6; }
4050        cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4051 /* end confdefs.h.  */
4052 #include <mpi.h>
4053 int
4054 main ()
4055 {
4056
4057  ;
4058  return 0;
4059 }
4060 _ACEOF
4061 if ac_fn_cxx_try_compile "$LINENO"; then :
4062  { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
4063 $as_echo "yes" >&6; }
4064 else
4065  MPILIBS=""
4066                { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4067 $as_echo "no" >&6; }
4068 fi
4069 rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
4070 fi
4071
4072 CXX="$ax_mpi_save_CXX"
4073
4074
4075
4076 # Finally, execute ACTION-IF-FOUND/ACTION-IF-NOT-FOUND:
4077 if test x = x"$MPILIBS"; then
4078        USE_MPI="no"
4079       { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: No suitable C++ MPI implementation found. oopse_MPI will not be built." >&5
4080 $as_echo "$as_me: WARNING: No suitable C++ MPI implementation found. oopse_MPI will not be built." >&2;}
4081        :
4082 else
4083        USE_MPI="yes"
4084        :
4085 fi
4086
3536   ac_ext=c
3537   ac_cpp='$CPP $CPPFLAGS'
3538   ac_compile='$CC -c $CFLAGS $CPPFLAGS conftest.$ac_ext >&5'
3539   ac_link='$CC -o conftest$ac_exeext $CFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
3540   ac_compiler_gnu=$ac_cv_c_compiler_gnu
3541   if test -n "$ac_tool_prefix"; then
3542 <  # Extract the first word of "${ac_tool_prefix}gcc", so it can be a program name with args.
4094 < set dummy ${ac_tool_prefix}gcc; ac_word=$2
4095 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
4096 < $as_echo_n "checking for $ac_word... " >&6; }
4097 < if test "${ac_cv_prog_CC+set}" = set; then :
4098 <  $as_echo_n "(cached) " >&6
4099 < else
4100 <  if test -n "$CC"; then
4101 <  ac_cv_prog_CC="$CC" # Let the user override the test.
4102 < else
4103 < as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
4104 < for as_dir in $PATH
4105 < do
4106 <  IFS=$as_save_IFS
4107 <  test -z "$as_dir" && as_dir=.
4108 <    for ac_exec_ext in '' $ac_executable_extensions; do
4109 <  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
4110 <    ac_cv_prog_CC="${ac_tool_prefix}gcc"
4111 <    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
4112 <    break 2
4113 <  fi
4114 < done
4115 <  done
4116 < IFS=$as_save_IFS
4117 <
4118 < fi
4119 < fi
4120 < CC=$ac_cv_prog_CC
4121 < if test -n "$CC"; then
4122 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $CC" >&5
4123 < $as_echo "$CC" >&6; }
4124 < else
4125 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4126 < $as_echo "no" >&6; }
4127 < fi
4128 <
4129 <
4130 < fi
4131 < if test -z "$ac_cv_prog_CC"; then
4132 <  ac_ct_CC=$CC
4133 <  # Extract the first word of "gcc", so it can be a program name with args.
4134 < set dummy gcc; ac_word=$2
4135 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
4136 < $as_echo_n "checking for $ac_word... " >&6; }
4137 < if test "${ac_cv_prog_ac_ct_CC+set}" = set; then :
4138 <  $as_echo_n "(cached) " >&6
4139 < else
4140 <  if test -n "$ac_ct_CC"; then
4141 <  ac_cv_prog_ac_ct_CC="$ac_ct_CC" # Let the user override the test.
4142 < else
4143 < as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
4144 < for as_dir in $PATH
4145 < do
4146 <  IFS=$as_save_IFS
4147 <  test -z "$as_dir" && as_dir=.
4148 <    for ac_exec_ext in '' $ac_executable_extensions; do
4149 <  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
4150 <    ac_cv_prog_ac_ct_CC="gcc"
4151 <    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
4152 <    break 2
4153 <  fi
4154 < done
4155 <  done
4156 < IFS=$as_save_IFS
4157 <
4158 < fi
4159 < fi
4160 < ac_ct_CC=$ac_cv_prog_ac_ct_CC
4161 < if test -n "$ac_ct_CC"; then
4162 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_ct_CC" >&5
4163 < $as_echo "$ac_ct_CC" >&6; }
4164 < else
4165 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4166 < $as_echo "no" >&6; }
4167 < fi
4168 <
4169 <  if test "x$ac_ct_CC" = x; then
4170 <    CC=""
4171 <  else
4172 <    case $cross_compiling:$ac_tool_warned in
4173 < yes:)
4174 < { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: using cross tools not prefixed with host triplet" >&5
4175 < $as_echo "$as_me: WARNING: using cross tools not prefixed with host triplet" >&2;}
4176 < ac_tool_warned=yes ;;
4177 < esac
4178 <    CC=$ac_ct_CC
4179 <  fi
4180 < else
4181 <  CC="$ac_cv_prog_CC"
4182 < fi
4183 <
4184 < if test -z "$CC"; then
4185 <          if test -n "$ac_tool_prefix"; then
4186 <    # Extract the first word of "${ac_tool_prefix}cc", so it can be a program name with args.
4187 < set dummy ${ac_tool_prefix}cc; ac_word=$2
4188 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
4189 < $as_echo_n "checking for $ac_word... " >&6; }
4190 < if test "${ac_cv_prog_CC+set}" = set; then :
4191 <  $as_echo_n "(cached) " >&6
4192 < else
4193 <  if test -n "$CC"; then
4194 <  ac_cv_prog_CC="$CC" # Let the user override the test.
4195 < else
4196 < as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
4197 < for as_dir in $PATH
4198 < do
4199 <  IFS=$as_save_IFS
4200 <  test -z "$as_dir" && as_dir=.
4201 <    for ac_exec_ext in '' $ac_executable_extensions; do
4202 <  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
4203 <    ac_cv_prog_CC="${ac_tool_prefix}cc"
4204 <    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
4205 <    break 2
4206 <  fi
4207 < done
4208 <  done
4209 < IFS=$as_save_IFS
4210 <
4211 < fi
4212 < fi
4213 < CC=$ac_cv_prog_CC
4214 < if test -n "$CC"; then
4215 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $CC" >&5
4216 < $as_echo "$CC" >&6; }
4217 < else
4218 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4219 < $as_echo "no" >&6; }
4220 < fi
4221 <
4222 <
4223 <  fi
4224 < fi
4225 < if test -z "$CC"; then
4226 <  # Extract the first word of "cc", so it can be a program name with args.
4227 < set dummy cc; ac_word=$2
4228 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
4229 < $as_echo_n "checking for $ac_word... " >&6; }
4230 < if test "${ac_cv_prog_CC+set}" = set; then :
4231 <  $as_echo_n "(cached) " >&6
4232 < else
4233 <  if test -n "$CC"; then
4234 <  ac_cv_prog_CC="$CC" # Let the user override the test.
4235 < else
4236 <  ac_prog_rejected=no
4237 < as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
4238 < for as_dir in $PATH
4239 < do
4240 <  IFS=$as_save_IFS
4241 <  test -z "$as_dir" && as_dir=.
4242 <    for ac_exec_ext in '' $ac_executable_extensions; do
4243 <  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
4244 <    if test "$as_dir/$ac_word$ac_exec_ext" = "/usr/ucb/cc"; then
4245 <       ac_prog_rejected=yes
4246 <       continue
4247 <     fi
4248 <    ac_cv_prog_CC="cc"
4249 <    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
4250 <    break 2
4251 <  fi
4252 < done
4253 <  done
4254 < IFS=$as_save_IFS
4255 <
4256 < if test $ac_prog_rejected = yes; then
4257 <  # We found a bogon in the path, so make sure we never use it.
4258 <  set dummy $ac_cv_prog_CC
4259 <  shift
4260 <  if test $# != 0; then
4261 <    # We chose a different compiler from the bogus one.
4262 <    # However, it has the same basename, so the bogon will be chosen
4263 <    # first if we set CC to just the basename; use the full file name.
4264 <    shift
4265 <    ac_cv_prog_CC="$as_dir/$ac_word${1+' '}$@"
4266 <  fi
4267 < fi
4268 < fi
4269 < fi
4270 < CC=$ac_cv_prog_CC
4271 < if test -n "$CC"; then
4272 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $CC" >&5
4273 < $as_echo "$CC" >&6; }
4274 < else
4275 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4276 < $as_echo "no" >&6; }
4277 < fi
4278 <
4279 <
4280 < fi
4281 < if test -z "$CC"; then
4282 <  if test -n "$ac_tool_prefix"; then
4283 <  for ac_prog in cl.exe
3542 >  for ac_prog in $CC icc pathcc pgcc cc xlc gcc
3543    do
3544      # Extract the first word of "$ac_tool_prefix$ac_prog", so it can be a program name with args.
3545   set dummy $ac_tool_prefix$ac_prog; ac_word=$2
# Line 4324 | Line 3583 | if test -z "$CC"; then
3583   fi
3584   if test -z "$CC"; then
3585    ac_ct_CC=$CC
3586 <  for ac_prog in cl.exe
3586 >  for ac_prog in $CC icc pathcc pgcc cc xlc gcc
3587   do
3588    # Extract the first word of "$ac_prog", so it can be a program name with args.
3589   set dummy $ac_prog; ac_word=$2
# Line 4379 | Line 3638 | fi
3638    fi
3639   fi
3640  
4382 fi
3641  
4384
3642   test -z "$CC" && { { $as_echo "$as_me:${as_lineno-$LINENO}: error: in \`$ac_pwd':" >&5
3643   $as_echo "$as_me: error: in \`$ac_pwd':" >&2;}
3644   as_fn_error "no acceptable C compiler found in \$PATH
# Line 4406 | Line 3663 | $as_echo "$ac_try_echo"; } >&5
3663   ... rest of stderr output deleted ...
3664           10q' conftest.err >conftest.er1
3665      cat conftest.er1 >&5
4409    rm -f conftest.er1 conftest.err
3666    fi
3667 +  rm -f conftest.er1 conftest.err
3668    $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
3669    test $ac_status = 0; }
3670   done
# Line 4623 | Line 3880 | ac_compiler_gnu=$ac_cv_c_compiler_gnu
3880   ac_compile='$CC -c $CFLAGS $CPPFLAGS conftest.$ac_ext >&5'
3881   ac_link='$CC -o conftest$ac_exeext $CFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
3882   ac_compiler_gnu=$ac_cv_c_compiler_gnu
4626
4627
4628 if test $USE_MPI != no; then :
4629
4630 ac_ext=c
4631 ac_cpp='$CPP $CPPFLAGS'
4632 ac_compile='$CC -c $CFLAGS $CPPFLAGS conftest.$ac_ext >&5'
4633 ac_link='$CC -o conftest$ac_exeext $CFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
4634 ac_compiler_gnu=$ac_cv_c_compiler_gnu
4635
4636
4637
4638
4639
4640
4641        for ac_prog in openmpicc mpicc hcc mpxlc_r mpxlc mpcc cmpicc
4642 do
4643  # Extract the first word of "$ac_prog", so it can be a program name with args.
4644 set dummy $ac_prog; ac_word=$2
4645 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
4646 $as_echo_n "checking for $ac_word... " >&6; }
4647 if test "${ac_cv_prog_MPICC+set}" = set; then :
4648  $as_echo_n "(cached) " >&6
4649 else
4650  if test -n "$MPICC"; then
4651  ac_cv_prog_MPICC="$MPICC" # Let the user override the test.
4652 else
4653 as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
4654 for as_dir in $PATH
4655 do
4656  IFS=$as_save_IFS
4657  test -z "$as_dir" && as_dir=.
4658    for ac_exec_ext in '' $ac_executable_extensions; do
4659  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
4660    ac_cv_prog_MPICC="$ac_prog"
4661    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
4662    break 2
4663  fi
4664 done
4665  done
4666 IFS=$as_save_IFS
4667
4668 fi
4669 fi
4670 MPICC=$ac_cv_prog_MPICC
4671 if test -n "$MPICC"; then
4672  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $MPICC" >&5
4673 $as_echo "$MPICC" >&6; }
4674 else
4675  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4676 $as_echo "no" >&6; }
4677 fi
4678
4679
4680  test -n "$MPICC" && break
4681 done
4682 test -n "$MPICC" || MPICC="$CC"
4683
4684        ax_mpi_save_CC="$CC"
4685        CC="$MPICC"
4686
4687
4688
4689 if test x = x"$MPILIBS"; then
4690        ac_fn_c_check_func "$LINENO" "MPI_Init" "ac_cv_func_MPI_Init"
4691 if test "x$ac_cv_func_MPI_Init" = x""yes; then :
4692  MPILIBS=" "
4693 fi
4694
4695 fi
4696
4697 if test x = x"$MPILIBS"; then
4698        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpi" >&5
4699 $as_echo_n "checking for MPI_Init in -lmpi... " >&6; }
4700 if test "${ac_cv_lib_mpi_MPI_Init+set}" = set; then :
4701  $as_echo_n "(cached) " >&6
4702 else
4703  ac_check_lib_save_LIBS=$LIBS
4704 LIBS="-lmpi  $LIBS"
4705 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4706 /* end confdefs.h.  */
4707
4708 /* Override any GCC internal prototype to avoid an error.
4709   Use char because int might match the return type of a GCC
4710   builtin and then its argument prototype would still apply.  */
4711 #ifdef __cplusplus
4712 extern "C"
4713 #endif
4714 char MPI_Init ();
4715 int
4716 main ()
4717 {
4718 return MPI_Init ();
4719  ;
4720  return 0;
4721 }
4722 _ACEOF
4723 if ac_fn_c_try_link "$LINENO"; then :
4724  ac_cv_lib_mpi_MPI_Init=yes
4725 else
4726  ac_cv_lib_mpi_MPI_Init=no
4727 fi
4728 rm -f core conftest.err conftest.$ac_objext \
4729    conftest$ac_exeext conftest.$ac_ext
4730 LIBS=$ac_check_lib_save_LIBS
4731 fi
4732 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpi_MPI_Init" >&5
4733 $as_echo "$ac_cv_lib_mpi_MPI_Init" >&6; }
4734 if test "x$ac_cv_lib_mpi_MPI_Init" = x""yes; then :
4735  MPILIBS="-lmpi"
4736 fi
3883  
4738 fi
4739 if test x = x"$MPILIBS"; then
4740        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpich" >&5
4741 $as_echo_n "checking for MPI_Init in -lmpich... " >&6; }
4742 if test "${ac_cv_lib_mpich_MPI_Init+set}" = set; then :
4743  $as_echo_n "(cached) " >&6
4744 else
4745  ac_check_lib_save_LIBS=$LIBS
4746 LIBS="-lmpich  $LIBS"
4747 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4748 /* end confdefs.h.  */
4749
4750 /* Override any GCC internal prototype to avoid an error.
4751   Use char because int might match the return type of a GCC
4752   builtin and then its argument prototype would still apply.  */
4753 #ifdef __cplusplus
4754 extern "C"
4755 #endif
4756 char MPI_Init ();
4757 int
4758 main ()
4759 {
4760 return MPI_Init ();
4761  ;
4762  return 0;
4763 }
4764 _ACEOF
4765 if ac_fn_c_try_link "$LINENO"; then :
4766  ac_cv_lib_mpich_MPI_Init=yes
4767 else
4768  ac_cv_lib_mpich_MPI_Init=no
4769 fi
4770 rm -f core conftest.err conftest.$ac_objext \
4771    conftest$ac_exeext conftest.$ac_ext
4772 LIBS=$ac_check_lib_save_LIBS
4773 fi
4774 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpich_MPI_Init" >&5
4775 $as_echo "$ac_cv_lib_mpich_MPI_Init" >&6; }
4776 if test "x$ac_cv_lib_mpich_MPI_Init" = x""yes; then :
4777  MPILIBS="-lmpich"
4778 fi
4779
4780 fi
4781
4782 if test x != x"$MPILIBS"; then
4783        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for mpi.h" >&5
4784 $as_echo_n "checking for mpi.h... " >&6; }
4785        cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4786 /* end confdefs.h.  */
4787 #include <mpi.h>
4788 int
4789 main ()
4790 {
4791
4792  ;
4793  return 0;
4794 }
4795 _ACEOF
4796 if ac_fn_c_try_compile "$LINENO"; then :
4797  { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
4798 $as_echo "yes" >&6; }
4799 else
4800  MPILIBS=""
4801                { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4802 $as_echo "no" >&6; }
4803 fi
4804 rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
4805 fi
4806
4807 CC="$ax_mpi_save_CC"
4808
4809
4810
4811 # Finally, execute ACTION-IF-FOUND/ACTION-IF-NOT-FOUND:
4812 if test x = x"$MPILIBS"; then
4813        USE_MPI="no"
4814       { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: No suitable C MPI implementation found. oopse_MPI will not be built." >&5
4815 $as_echo "$as_me: WARNING: No suitable C MPI implementation found. oopse_MPI will not be built." >&2;}
4816        :
4817 else
4818        USE_MPI="yes"
4819        :
4820 fi
4821
4822
4823 fi
3884   ac_ext=${ac_fc_srcext-f}
3885   ac_compile='$FC -c $FCFLAGS $ac_fcflags_srcext conftest.$ac_ext >&5'
3886   ac_link='$FC -o conftest$ac_exeext $FCFLAGS $LDFLAGS $ac_fcflags_srcext conftest.$ac_ext $LIBS >&5'
3887   ac_compiler_gnu=$ac_cv_fc_compiler_gnu
3888   if test -n "$ac_tool_prefix"; then
3889 <  for ac_prog in gfortran g95 xlf95 f95 fort ifort ifc efc pgf95 lf95 ftn xlf90 f90 pgf90 pghpf epcf90 g77 xlf f77 frt pgf77 cf77 fort77 fl32 af77
3889 >  for ac_prog in $FC ifort ifc pathf95 pgf95 xlf95 lf95 epcf90 pathf90 xlf90 f95 f90 gfortran g95 fort
3890    do
3891      # Extract the first word of "$ac_tool_prefix$ac_prog", so it can be a program name with args.
3892   set dummy $ac_tool_prefix$ac_prog; ac_word=$2
# Line 4870 | Line 3930 | if test -z "$FC"; then
3930   fi
3931   if test -z "$FC"; then
3932    ac_ct_FC=$FC
3933 <  for ac_prog in gfortran g95 xlf95 f95 fort ifort ifc efc pgf95 lf95 ftn xlf90 f90 pgf90 pghpf epcf90 g77 xlf f77 frt pgf77 cf77 fort77 fl32 af77
3933 >  for ac_prog in $FC ifort ifc pathf95 pgf95 xlf95 lf95 epcf90 pathf90 xlf90 f95 f90 gfortran g95 fort
3934   do
3935    # Extract the first word of "$ac_prog", so it can be a program name with args.
3936   set dummy $ac_prog; ac_word=$2
# Line 4945 | Line 4005 | $as_echo "$ac_try_echo"; } >&5
4005   ... rest of stderr output deleted ...
4006           10q' conftest.err >conftest.er1
4007      cat conftest.er1 >&5
4948    rm -f conftest.er1 conftest.err
4008    fi
4009 +  rm -f conftest.er1 conftest.err
4010    $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
4011    test $ac_status = 0; }
4012   done
# Line 5021 | Line 4081 | fi
4081    fi
4082   fi
4083  
4084 < ac_ext=${ac_fc_srcext-f}
4085 < ac_compile='$FC -c $FCFLAGS $ac_fcflags_srcext conftest.$ac_ext >&5'
4086 < ac_link='$FC -o conftest$ac_exeext $FCFLAGS $LDFLAGS $ac_fcflags_srcext conftest.$ac_ext $LIBS >&5'
4087 < ac_compiler_gnu=$ac_cv_fc_compiler_gnu
4084 > ac_ext=c
4085 > ac_cpp='$CPP $CPPFLAGS'
4086 > ac_compile='$CC -c $CFLAGS $CPPFLAGS conftest.$ac_ext >&5'
4087 > ac_link='$CC -o conftest$ac_exeext $CFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
4088 > ac_compiler_gnu=$ac_cv_c_compiler_gnu
4089  
4090  
4091 < if test $USE_MPI != no; then :
4091 > save_CXX=$CXX
4092 > save_CC=$CC
4093 > save_FC=$FC
4094 > save_LIBS=$LIBS
4095  
4096 < ac_ext=${ac_fc_srcext-f}
4097 < ac_compile='$FC -c $FCFLAGS $ac_fcflags_srcext conftest.$ac_ext >&5'
4098 < ac_link='$FC -o conftest$ac_exeext $FCFLAGS $LDFLAGS $ac_fcflags_srcext conftest.$ac_ext $LIBS >&5'
4099 < ac_compiler_gnu=$ac_cv_fc_compiler_gnu
4096 > ac_ext=cpp
4097 > ac_cpp='$CXXCPP $CPPFLAGS'
4098 > ac_compile='$CXX -c $CXXFLAGS $CPPFLAGS conftest.$ac_ext >&5'
4099 > ac_link='$CXX -o conftest$ac_exeext $CXXFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
4100 > ac_compiler_gnu=$ac_cv_cxx_compiler_gnu
4101 >
4102 >
4103 > { $as_echo "$as_me:${as_lineno-$LINENO}: checking for dlopen in -lc" >&5
4104 > $as_echo_n "checking for dlopen in -lc... " >&6; }
4105 > if test "${ac_cv_lib_c_dlopen+set}" = set; then :
4106 >  $as_echo_n "(cached) " >&6
4107 > else
4108 >  ac_check_lib_save_LIBS=$LIBS
4109 > LIBS="-lc  $LIBS"
4110 > cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4111 > /* end confdefs.h.  */
4112  
4113 + /* Override any GCC internal prototype to avoid an error.
4114 +   Use char because int might match the return type of a GCC
4115 +   builtin and then its argument prototype would still apply.  */
4116 + #ifdef __cplusplus
4117 + extern "C"
4118 + #endif
4119 + char dlopen ();
4120 + int
4121 + main ()
4122 + {
4123 + return dlopen ();
4124 +  ;
4125 +  return 0;
4126 + }
4127 + _ACEOF
4128 + if ac_fn_cxx_try_link "$LINENO"; then :
4129 +  ac_cv_lib_c_dlopen=yes
4130 + else
4131 +  ac_cv_lib_c_dlopen=no
4132 + fi
4133 + rm -f core conftest.err conftest.$ac_objext \
4134 +    conftest$ac_exeext conftest.$ac_ext
4135 + LIBS=$ac_check_lib_save_LIBS
4136 + fi
4137 + { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_c_dlopen" >&5
4138 + $as_echo "$ac_cv_lib_c_dlopen" >&6; }
4139 + if test "x$ac_cv_lib_c_dlopen" = x""yes; then :
4140 +  LIBDL=""
4141 + else
4142 +  { $as_echo "$as_me:${as_lineno-$LINENO}: checking for dlopen in -ldl" >&5
4143 + $as_echo_n "checking for dlopen in -ldl... " >&6; }
4144 + if test "${ac_cv_lib_dl_dlopen+set}" = set; then :
4145 +  $as_echo_n "(cached) " >&6
4146 + else
4147 +  ac_check_lib_save_LIBS=$LIBS
4148 + LIBS="-ldl  $LIBS"
4149 + cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4150 + /* end confdefs.h.  */
4151  
4152 + /* Override any GCC internal prototype to avoid an error.
4153 +   Use char because int might match the return type of a GCC
4154 +   builtin and then its argument prototype would still apply.  */
4155 + #ifdef __cplusplus
4156 + extern "C"
4157 + #endif
4158 + char dlopen ();
4159 + int
4160 + main ()
4161 + {
4162 + return dlopen ();
4163 +  ;
4164 +  return 0;
4165 + }
4166 + _ACEOF
4167 + if ac_fn_cxx_try_link "$LINENO"; then :
4168 +  ac_cv_lib_dl_dlopen=yes
4169 + else
4170 +  ac_cv_lib_dl_dlopen=no
4171 + fi
4172 + rm -f core conftest.err conftest.$ac_objext \
4173 +    conftest$ac_exeext conftest.$ac_ext
4174 + LIBS=$ac_check_lib_save_LIBS
4175 + fi
4176 + { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_dl_dlopen" >&5
4177 + $as_echo "$ac_cv_lib_dl_dlopen" >&6; }
4178 + if test "x$ac_cv_lib_dl_dlopen" = x""yes; then :
4179 +  LIBDL="-ldl"
4180 + fi
4181  
4182 + fi
4183  
4184  
4185  
4186 <        for ac_prog in openmpif90 mpif90 mpxlf95_r mpxlf90_r mpxlf95 mpxlf90 mpf90 cmpif90c
4186 >
4187 >
4188 >
4189 >
4190 >        for ac_prog in openmpicxx openmpiCC openmpic++ mpic++ mpicxx mpiCC hcp mpxlC_r mpxlC mpCC cmpic++
4191   do
4192    # Extract the first word of "$ac_prog", so it can be a program name with args.
4193   set dummy $ac_prog; ac_word=$2
4194   { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
4195   $as_echo_n "checking for $ac_word... " >&6; }
4196 < if test "${ac_cv_prog_MPIFC+set}" = set; then :
4196 > if test "${ac_cv_prog_MPICXX+set}" = set; then :
4197    $as_echo_n "(cached) " >&6
4198   else
4199 <  if test -n "$MPIFC"; then
4200 <  ac_cv_prog_MPIFC="$MPIFC" # Let the user override the test.
4199 >  if test -n "$MPICXX"; then
4200 >  ac_cv_prog_MPICXX="$MPICXX" # Let the user override the test.
4201   else
4202   as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
4203   for as_dir in $PATH
# Line 5058 | Line 4206 | do
4206    test -z "$as_dir" && as_dir=.
4207      for ac_exec_ext in '' $ac_executable_extensions; do
4208    if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
4209 <    ac_cv_prog_MPIFC="$ac_prog"
4209 >    ac_cv_prog_MPICXX="$ac_prog"
4210      $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
4211      break 2
4212    fi
# Line 5068 | Line 4216 | fi
4216  
4217   fi
4218   fi
4219 < MPIFC=$ac_cv_prog_MPIFC
4220 < if test -n "$MPIFC"; then
4221 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $MPIFC" >&5
4222 < $as_echo "$MPIFC" >&6; }
4219 > MPICXX=$ac_cv_prog_MPICXX
4220 > if test -n "$MPICXX"; then
4221 >  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $MPICXX" >&5
4222 > $as_echo "$MPICXX" >&6; }
4223   else
4224    { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4225   $as_echo "no" >&6; }
4226   fi
4227  
4228  
4229 <  test -n "$MPIFC" && break
4229 >  test -n "$MPICXX" && break
4230   done
4231 < test -n "$MPIFC" || MPIFC="$FC"
4231 > test -n "$MPICXX" || MPICXX="$CXX"
4232  
4233 <        ax_mpi_save_FC="$FC"
4234 <        FC="$MPIFC"
4233 >        ax_mpi_save_CXX="$CXX"
4234 >        CXX="$MPICXX"
4235  
4236  
4237  
4238   if test x = x"$MPILIBS"; then
4239 <        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init" >&5
4240 < $as_echo_n "checking for MPI_Init... " >&6; }
5093 <                        cat > conftest.$ac_ext <<_ACEOF
5094 <      program main
5095 <      call MPI_Init
5096 <      end
5097 < _ACEOF
5098 < if ac_fn_fc_try_link "$LINENO"; then :
4239 >        ac_fn_cxx_check_func "$LINENO" "MPI_Init" "ac_cv_func_MPI_Init"
4240 > if test "x$ac_cv_func_MPI_Init" = x""yes; then :
4241    MPILIBS=" "
5100                                { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
5101 $as_echo "yes" >&6; }
5102 else
5103  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
5104 $as_echo "no" >&6; }
4242   fi
5106 rm -f core conftest.err conftest.$ac_objext \
5107    conftest$ac_exeext conftest.$ac_ext
5108 fi
4243  
5110        if test x = x"$MPILIBS"; then
5111                { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lfmpi" >&5
5112 $as_echo_n "checking for MPI_Init in -lfmpi... " >&6; }
5113 if test "${ac_cv_lib_fmpi_MPI_Init+set}" = set; then :
5114  $as_echo_n "(cached) " >&6
5115 else
5116  ac_check_lib_save_LIBS=$LIBS
5117 LIBS="-lfmpi  $LIBS"
5118 cat > conftest.$ac_ext <<_ACEOF
5119      program main
5120      call MPI_Init
5121      end
5122 _ACEOF
5123 if ac_fn_fc_try_link "$LINENO"; then :
5124  ac_cv_lib_fmpi_MPI_Init=yes
5125 else
5126  ac_cv_lib_fmpi_MPI_Init=no
4244   fi
5128 rm -f core conftest.err conftest.$ac_objext \
5129    conftest$ac_exeext conftest.$ac_ext
5130 LIBS=$ac_check_lib_save_LIBS
5131 fi
5132 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_fmpi_MPI_Init" >&5
5133 $as_echo "$ac_cv_lib_fmpi_MPI_Init" >&6; }
5134 if test "x$ac_cv_lib_fmpi_MPI_Init" = x""yes; then :
5135  MPILIBS="-lfmpi"
5136 fi
4245  
5138        fi
5139        if test x = x"$MPILIBS"; then
5140                { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpichf90" >&5
5141 $as_echo_n "checking for MPI_Init in -lmpichf90... " >&6; }
5142 if test "${ac_cv_lib_mpichf90_MPI_Init+set}" = set; then :
5143  $as_echo_n "(cached) " >&6
5144 else
5145  ac_check_lib_save_LIBS=$LIBS
5146 LIBS="-lmpichf90  $LIBS"
5147 cat > conftest.$ac_ext <<_ACEOF
5148      program main
5149      call MPI_Init
5150      end
5151 _ACEOF
5152 if ac_fn_fc_try_link "$LINENO"; then :
5153  ac_cv_lib_mpichf90_MPI_Init=yes
5154 else
5155  ac_cv_lib_mpichf90_MPI_Init=no
5156 fi
5157 rm -f core conftest.err conftest.$ac_objext \
5158    conftest$ac_exeext conftest.$ac_ext
5159 LIBS=$ac_check_lib_save_LIBS
5160 fi
5161 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpichf90_MPI_Init" >&5
5162 $as_echo "$ac_cv_lib_mpichf90_MPI_Init" >&6; }
5163 if test "x$ac_cv_lib_mpichf90_MPI_Init" = x""yes; then :
5164  MPILIBS="-lmpichf90"
5165 fi
5166
5167        fi
5168
4246   if test x = x"$MPILIBS"; then
4247          { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpi" >&5
4248   $as_echo_n "checking for MPI_Init in -lmpi... " >&6; }
# Line 5174 | Line 4251 | LIBS="-lmpi  $LIBS"
4251   else
4252    ac_check_lib_save_LIBS=$LIBS
4253   LIBS="-lmpi  $LIBS"
4254 < cat > conftest.$ac_ext <<_ACEOF
4255 <      program main
4256 <      call MPI_Init
4257 <      end
4254 > cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4255 > /* end confdefs.h.  */
4256 >
4257 > /* Override any GCC internal prototype to avoid an error.
4258 >   Use char because int might match the return type of a GCC
4259 >   builtin and then its argument prototype would still apply.  */
4260 > #ifdef __cplusplus
4261 > extern "C"
4262 > #endif
4263 > char MPI_Init ();
4264 > int
4265 > main ()
4266 > {
4267 > return MPI_Init ();
4268 >  ;
4269 >  return 0;
4270 > }
4271   _ACEOF
4272 < if ac_fn_fc_try_link "$LINENO"; then :
4272 > if ac_fn_cxx_try_link "$LINENO"; then :
4273    ac_cv_lib_mpi_MPI_Init=yes
4274   else
4275    ac_cv_lib_mpi_MPI_Init=no
# Line 5203 | Line 4293 | LIBS="-lmpich  $LIBS"
4293   else
4294    ac_check_lib_save_LIBS=$LIBS
4295   LIBS="-lmpich  $LIBS"
4296 < cat > conftest.$ac_ext <<_ACEOF
4297 <      program main
4298 <      call MPI_Init
4299 <      end
4296 > cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4297 > /* end confdefs.h.  */
4298 >
4299 > /* Override any GCC internal prototype to avoid an error.
4300 >   Use char because int might match the return type of a GCC
4301 >   builtin and then its argument prototype would still apply.  */
4302 > #ifdef __cplusplus
4303 > extern "C"
4304 > #endif
4305 > char MPI_Init ();
4306 > int
4307 > main ()
4308 > {
4309 > return MPI_Init ();
4310 >  ;
4311 >  return 0;
4312 > }
4313   _ACEOF
4314 < if ac_fn_fc_try_link "$LINENO"; then :
4314 > if ac_fn_cxx_try_link "$LINENO"; then :
4315    ac_cv_lib_mpich_MPI_Init=yes
4316   else
4317    ac_cv_lib_mpich_MPI_Init=no
# Line 5226 | Line 4329 | if test x != x"$MPILIBS"; then
4329   fi
4330  
4331   if test x != x"$MPILIBS"; then
4332 <        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for mpif.h" >&5
4333 < $as_echo_n "checking for mpif.h... " >&6; }
4334 <        cat > conftest.$ac_ext <<_ACEOF
4335 <      program main
4336 <      include 'mpif.h'
4337 <      end
4332 >        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for mpi.h" >&5
4333 > $as_echo_n "checking for mpi.h... " >&6; }
4334 >        cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4335 > /* end confdefs.h.  */
4336 > #include <mpi.h>
4337 > int
4338 > main ()
4339 > {
4340 >
4341 >  ;
4342 >  return 0;
4343 > }
4344   _ACEOF
4345 < if ac_fn_fc_try_compile "$LINENO"; then :
4345 > if ac_fn_cxx_try_compile "$LINENO"; then :
4346    { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
4347   $as_echo "yes" >&6; }
4348   else
# Line 5244 | Line 4353 | fi
4353   rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
4354   fi
4355  
4356 < FC="$ax_mpi_save_FC"
4356 > CXX="$ax_mpi_save_CXX"
4357  
4358  
4359  
4360   # Finally, execute ACTION-IF-FOUND/ACTION-IF-NOT-FOUND:
4361   if test x = x"$MPILIBS"; then
4362          USE_MPI="no"
4363 <       { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: No suitable Fortran MPI implementation found. oopse_MPI will not be built." >&5
4364 < $as_echo "$as_me: WARNING: No suitable Fortran MPI implementation found. oopse_MPI will not be built." >&2;}
4363 >       { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: No suitable C++ MPI implementation found. openmd_MPI will not be built." >&5
4364 > $as_echo "$as_me: WARNING: No suitable C++ MPI implementation found. openmd_MPI will not be built." >&2;}
4365          :
4366   else
4367          USE_MPI="yes"
# Line 5260 | Line 4369 | fi
4369   fi
4370  
4371  
5263 fi
4372   if test $USE_MPI != no; then :
4373  
5266        CXX=$MPICXX
5267        CC=$MPICC
5268        FC=$MPIFC
5269
5270 fi
5271
5272
5273 # Checks for programs.
5274 ac_ext=cpp
5275 ac_cpp='$CXXCPP $CPPFLAGS'
5276 ac_compile='$CXX -c $CXXFLAGS $CPPFLAGS conftest.$ac_ext >&5'
5277 ac_link='$CXX -o conftest$ac_exeext $CXXFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
5278 ac_compiler_gnu=$ac_cv_cxx_compiler_gnu
5279 if test -z "$CXX"; then
5280  if test -n "$CCC"; then
5281    CXX=$CCC
5282  else
5283    if test -n "$ac_tool_prefix"; then
5284  for ac_prog in $CXX icpc pathCC pgCC c++ xlc++ xlC g++ CC
5285  do
5286    # Extract the first word of "$ac_tool_prefix$ac_prog", so it can be a program name with args.
5287 set dummy $ac_tool_prefix$ac_prog; ac_word=$2
5288 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
5289 $as_echo_n "checking for $ac_word... " >&6; }
5290 if test "${ac_cv_prog_CXX+set}" = set; then :
5291  $as_echo_n "(cached) " >&6
5292 else
5293  if test -n "$CXX"; then
5294  ac_cv_prog_CXX="$CXX" # Let the user override the test.
5295 else
5296 as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
5297 for as_dir in $PATH
5298 do
5299  IFS=$as_save_IFS
5300  test -z "$as_dir" && as_dir=.
5301    for ac_exec_ext in '' $ac_executable_extensions; do
5302  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
5303    ac_cv_prog_CXX="$ac_tool_prefix$ac_prog"
5304    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
5305    break 2
5306  fi
5307 done
5308  done
5309 IFS=$as_save_IFS
5310
5311 fi
5312 fi
5313 CXX=$ac_cv_prog_CXX
5314 if test -n "$CXX"; then
5315  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $CXX" >&5
5316 $as_echo "$CXX" >&6; }
5317 else
5318  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
5319 $as_echo "no" >&6; }
5320 fi
5321
5322
5323    test -n "$CXX" && break
5324  done
5325 fi
5326 if test -z "$CXX"; then
5327  ac_ct_CXX=$CXX
5328  for ac_prog in $CXX icpc pathCC pgCC c++ xlc++ xlC g++ CC
5329 do
5330  # Extract the first word of "$ac_prog", so it can be a program name with args.
5331 set dummy $ac_prog; ac_word=$2
5332 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
5333 $as_echo_n "checking for $ac_word... " >&6; }
5334 if test "${ac_cv_prog_ac_ct_CXX+set}" = set; then :
5335  $as_echo_n "(cached) " >&6
5336 else
5337  if test -n "$ac_ct_CXX"; then
5338  ac_cv_prog_ac_ct_CXX="$ac_ct_CXX" # Let the user override the test.
5339 else
5340 as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
5341 for as_dir in $PATH
5342 do
5343  IFS=$as_save_IFS
5344  test -z "$as_dir" && as_dir=.
5345    for ac_exec_ext in '' $ac_executable_extensions; do
5346  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
5347    ac_cv_prog_ac_ct_CXX="$ac_prog"
5348    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
5349    break 2
5350  fi
5351 done
5352  done
5353 IFS=$as_save_IFS
5354
5355 fi
5356 fi
5357 ac_ct_CXX=$ac_cv_prog_ac_ct_CXX
5358 if test -n "$ac_ct_CXX"; then
5359  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_ct_CXX" >&5
5360 $as_echo "$ac_ct_CXX" >&6; }
5361 else
5362  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
5363 $as_echo "no" >&6; }
5364 fi
5365
5366
5367  test -n "$ac_ct_CXX" && break
5368 done
5369
5370  if test "x$ac_ct_CXX" = x; then
5371    CXX="g++"
5372  else
5373    case $cross_compiling:$ac_tool_warned in
5374 yes:)
5375 { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: using cross tools not prefixed with host triplet" >&5
5376 $as_echo "$as_me: WARNING: using cross tools not prefixed with host triplet" >&2;}
5377 ac_tool_warned=yes ;;
5378 esac
5379    CXX=$ac_ct_CXX
5380  fi
5381 fi
5382
5383  fi
5384 fi
5385 # Provide some information about the compiler.
5386 $as_echo "$as_me:${as_lineno-$LINENO}: checking for C++ compiler version" >&5
5387 set X $ac_compile
5388 ac_compiler=$2
5389 for ac_option in --version -v -V -qversion; do
5390  { { ac_try="$ac_compiler $ac_option >&5"
5391 case "(($ac_try" in
5392  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
5393  *) ac_try_echo=$ac_try;;
5394 esac
5395 eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
5396 $as_echo "$ac_try_echo"; } >&5
5397  (eval "$ac_compiler $ac_option >&5") 2>conftest.err
5398  ac_status=$?
5399  if test -s conftest.err; then
5400    sed '10a\
5401 ... rest of stderr output deleted ...
5402         10q' conftest.err >conftest.er1
5403    cat conftest.er1 >&5
5404    rm -f conftest.er1 conftest.err
5405  fi
5406  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
5407  test $ac_status = 0; }
5408 done
5409
5410 { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether we are using the GNU C++ compiler" >&5
5411 $as_echo_n "checking whether we are using the GNU C++ compiler... " >&6; }
5412 if test "${ac_cv_cxx_compiler_gnu+set}" = set; then :
5413  $as_echo_n "(cached) " >&6
5414 else
5415  cat confdefs.h - <<_ACEOF >conftest.$ac_ext
5416 /* end confdefs.h.  */
5417
5418 int
5419 main ()
5420 {
5421 #ifndef __GNUC__
5422       choke me
5423 #endif
5424
5425  ;
5426  return 0;
5427 }
5428 _ACEOF
5429 if ac_fn_cxx_try_compile "$LINENO"; then :
5430  ac_compiler_gnu=yes
5431 else
5432  ac_compiler_gnu=no
5433 fi
5434 rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
5435 ac_cv_cxx_compiler_gnu=$ac_compiler_gnu
5436
5437 fi
5438 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_cxx_compiler_gnu" >&5
5439 $as_echo "$ac_cv_cxx_compiler_gnu" >&6; }
5440 if test $ac_compiler_gnu = yes; then
5441  GXX=yes
5442 else
5443  GXX=
5444 fi
5445 ac_test_CXXFLAGS=${CXXFLAGS+set}
5446 ac_save_CXXFLAGS=$CXXFLAGS
5447 { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether $CXX accepts -g" >&5
5448 $as_echo_n "checking whether $CXX accepts -g... " >&6; }
5449 if test "${ac_cv_prog_cxx_g+set}" = set; then :
5450  $as_echo_n "(cached) " >&6
5451 else
5452  ac_save_cxx_werror_flag=$ac_cxx_werror_flag
5453   ac_cxx_werror_flag=yes
5454   ac_cv_prog_cxx_g=no
5455   CXXFLAGS="-g"
5456   cat confdefs.h - <<_ACEOF >conftest.$ac_ext
5457 /* end confdefs.h.  */
5458
5459 int
5460 main ()
5461 {
5462
5463  ;
5464  return 0;
5465 }
5466 _ACEOF
5467 if ac_fn_cxx_try_compile "$LINENO"; then :
5468  ac_cv_prog_cxx_g=yes
5469 else
5470  CXXFLAGS=""
5471      cat confdefs.h - <<_ACEOF >conftest.$ac_ext
5472 /* end confdefs.h.  */
5473
5474 int
5475 main ()
5476 {
5477
5478  ;
5479  return 0;
5480 }
5481 _ACEOF
5482 if ac_fn_cxx_try_compile "$LINENO"; then :
5483
5484 else
5485  ac_cxx_werror_flag=$ac_save_cxx_werror_flag
5486         CXXFLAGS="-g"
5487         cat confdefs.h - <<_ACEOF >conftest.$ac_ext
5488 /* end confdefs.h.  */
5489
5490 int
5491 main ()
5492 {
5493
5494  ;
5495  return 0;
5496 }
5497 _ACEOF
5498 if ac_fn_cxx_try_compile "$LINENO"; then :
5499  ac_cv_prog_cxx_g=yes
5500 fi
5501 rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
5502 fi
5503 rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
5504 fi
5505 rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
5506   ac_cxx_werror_flag=$ac_save_cxx_werror_flag
5507 fi
5508 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_prog_cxx_g" >&5
5509 $as_echo "$ac_cv_prog_cxx_g" >&6; }
5510 if test "$ac_test_CXXFLAGS" = set; then
5511  CXXFLAGS=$ac_save_CXXFLAGS
5512 elif test $ac_cv_prog_cxx_g = yes; then
5513  if test "$GXX" = yes; then
5514    CXXFLAGS="-g -O2"
5515  else
5516    CXXFLAGS="-g"
5517  fi
5518 else
5519  if test "$GXX" = yes; then
5520    CXXFLAGS="-O2"
5521  else
5522    CXXFLAGS=
5523  fi
5524 fi
5525 ac_ext=${ac_fc_srcext-f}
5526 ac_compile='$FC -c $FCFLAGS $ac_fcflags_srcext conftest.$ac_ext >&5'
5527 ac_link='$FC -o conftest$ac_exeext $FCFLAGS $LDFLAGS $ac_fcflags_srcext conftest.$ac_ext $LIBS >&5'
5528 ac_compiler_gnu=$ac_cv_fc_compiler_gnu
5529
4374   ac_ext=c
4375   ac_cpp='$CPP $CPPFLAGS'
4376   ac_compile='$CC -c $CFLAGS $CPPFLAGS conftest.$ac_ext >&5'
4377   ac_link='$CC -o conftest$ac_exeext $CFLAGS $CPPFLAGS $LDFLAGS conftest.$ac_ext $LIBS >&5'
4378   ac_compiler_gnu=$ac_cv_c_compiler_gnu
5535 if test -n "$ac_tool_prefix"; then
5536  for ac_prog in $CC icc pathcc pgcc cc xlc gcc
5537  do
5538    # Extract the first word of "$ac_tool_prefix$ac_prog", so it can be a program name with args.
5539 set dummy $ac_tool_prefix$ac_prog; ac_word=$2
5540 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
5541 $as_echo_n "checking for $ac_word... " >&6; }
5542 if test "${ac_cv_prog_CC+set}" = set; then :
5543  $as_echo_n "(cached) " >&6
5544 else
5545  if test -n "$CC"; then
5546  ac_cv_prog_CC="$CC" # Let the user override the test.
5547 else
5548 as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
5549 for as_dir in $PATH
5550 do
5551  IFS=$as_save_IFS
5552  test -z "$as_dir" && as_dir=.
5553    for ac_exec_ext in '' $ac_executable_extensions; do
5554  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
5555    ac_cv_prog_CC="$ac_tool_prefix$ac_prog"
5556    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
5557    break 2
5558  fi
5559 done
5560  done
5561 IFS=$as_save_IFS
4379  
5563 fi
5564 fi
5565 CC=$ac_cv_prog_CC
5566 if test -n "$CC"; then
5567  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $CC" >&5
5568 $as_echo "$CC" >&6; }
5569 else
5570  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
5571 $as_echo "no" >&6; }
5572 fi
4380  
4381  
4382 <    test -n "$CC" && break
4383 <  done
4384 < fi
4385 < if test -z "$CC"; then
5579 <  ac_ct_CC=$CC
5580 <  for ac_prog in $CC icc pathcc pgcc cc xlc gcc
4382 >
4383 >
4384 >
4385 >        for ac_prog in openmpicc mpicc hcc mpxlc_r mpxlc mpcc cmpicc
4386   do
4387    # Extract the first word of "$ac_prog", so it can be a program name with args.
4388   set dummy $ac_prog; ac_word=$2
4389   { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
4390   $as_echo_n "checking for $ac_word... " >&6; }
4391 < if test "${ac_cv_prog_ac_ct_CC+set}" = set; then :
4391 > if test "${ac_cv_prog_MPICC+set}" = set; then :
4392    $as_echo_n "(cached) " >&6
4393   else
4394 <  if test -n "$ac_ct_CC"; then
4395 <  ac_cv_prog_ac_ct_CC="$ac_ct_CC" # Let the user override the test.
4394 >  if test -n "$MPICC"; then
4395 >  ac_cv_prog_MPICC="$MPICC" # Let the user override the test.
4396   else
4397   as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
4398   for as_dir in $PATH
# Line 5596 | Line 4401 | do
4401    test -z "$as_dir" && as_dir=.
4402      for ac_exec_ext in '' $ac_executable_extensions; do
4403    if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
4404 <    ac_cv_prog_ac_ct_CC="$ac_prog"
4404 >    ac_cv_prog_MPICC="$ac_prog"
4405      $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
4406      break 2
4407    fi
# Line 5606 | Line 4411 | fi
4411  
4412   fi
4413   fi
4414 < ac_ct_CC=$ac_cv_prog_ac_ct_CC
4415 < if test -n "$ac_ct_CC"; then
4416 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_ct_CC" >&5
4417 < $as_echo "$ac_ct_CC" >&6; }
4414 > MPICC=$ac_cv_prog_MPICC
4415 > if test -n "$MPICC"; then
4416 >  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $MPICC" >&5
4417 > $as_echo "$MPICC" >&6; }
4418   else
4419    { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4420   $as_echo "no" >&6; }
4421   fi
4422  
4423  
4424 <  test -n "$ac_ct_CC" && break
5620 < done
5621 <
5622 <  if test "x$ac_ct_CC" = x; then
5623 <    CC=""
5624 <  else
5625 <    case $cross_compiling:$ac_tool_warned in
5626 < yes:)
5627 < { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: using cross tools not prefixed with host triplet" >&5
5628 < $as_echo "$as_me: WARNING: using cross tools not prefixed with host triplet" >&2;}
5629 < ac_tool_warned=yes ;;
5630 < esac
5631 <    CC=$ac_ct_CC
5632 <  fi
5633 < fi
5634 <
5635 <
5636 < test -z "$CC" && { { $as_echo "$as_me:${as_lineno-$LINENO}: error: in \`$ac_pwd':" >&5
5637 < $as_echo "$as_me: error: in \`$ac_pwd':" >&2;}
5638 < as_fn_error "no acceptable C compiler found in \$PATH
5639 < See \`config.log' for more details." "$LINENO" 5; }
5640 <
5641 < # Provide some information about the compiler.
5642 < $as_echo "$as_me:${as_lineno-$LINENO}: checking for C compiler version" >&5
5643 < set X $ac_compile
5644 < ac_compiler=$2
5645 < for ac_option in --version -v -V -qversion; do
5646 <  { { ac_try="$ac_compiler $ac_option >&5"
5647 < case "(($ac_try" in
5648 <  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
5649 <  *) ac_try_echo=$ac_try;;
5650 < esac
5651 < eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
5652 < $as_echo "$ac_try_echo"; } >&5
5653 <  (eval "$ac_compiler $ac_option >&5") 2>conftest.err
5654 <  ac_status=$?
5655 <  if test -s conftest.err; then
5656 <    sed '10a\
5657 < ... rest of stderr output deleted ...
5658 <         10q' conftest.err >conftest.er1
5659 <    cat conftest.er1 >&5
5660 <    rm -f conftest.er1 conftest.err
5661 <  fi
5662 <  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
5663 <  test $ac_status = 0; }
4424 >  test -n "$MPICC" && break
4425   done
4426 + test -n "$MPICC" || MPICC="$CC"
4427  
4428 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether we are using the GNU C compiler" >&5
4429 < $as_echo_n "checking whether we are using the GNU C compiler... " >&6; }
4430 < if test "${ac_cv_c_compiler_gnu+set}" = set; then :
4428 >        ax_mpi_save_CC="$CC"
4429 >        CC="$MPICC"
4430 >
4431 >
4432 >
4433 > if test x = x"$MPILIBS"; then
4434 >        ac_fn_c_check_func "$LINENO" "MPI_Init" "ac_cv_func_MPI_Init"
4435 > if test "x$ac_cv_func_MPI_Init" = x""yes; then :
4436 >  MPILIBS=" "
4437 > fi
4438 >
4439 > fi
4440 >
4441 > if test x = x"$MPILIBS"; then
4442 >        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpi" >&5
4443 > $as_echo_n "checking for MPI_Init in -lmpi... " >&6; }
4444 > if test "${ac_cv_lib_mpi_MPI_Init+set}" = set; then :
4445    $as_echo_n "(cached) " >&6
4446   else
4447 <  cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4447 >  ac_check_lib_save_LIBS=$LIBS
4448 > LIBS="-lmpi  $LIBS"
4449 > cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4450   /* end confdefs.h.  */
4451  
4452 + /* Override any GCC internal prototype to avoid an error.
4453 +   Use char because int might match the return type of a GCC
4454 +   builtin and then its argument prototype would still apply.  */
4455 + #ifdef __cplusplus
4456 + extern "C"
4457 + #endif
4458 + char MPI_Init ();
4459   int
4460   main ()
4461   {
4462 < #ifndef __GNUC__
5678 <       choke me
5679 < #endif
5680 <
4462 > return MPI_Init ();
4463    ;
4464    return 0;
4465   }
4466   _ACEOF
4467 < if ac_fn_c_try_compile "$LINENO"; then :
4468 <  ac_compiler_gnu=yes
4467 > if ac_fn_c_try_link "$LINENO"; then :
4468 >  ac_cv_lib_mpi_MPI_Init=yes
4469   else
4470 <  ac_compiler_gnu=no
4470 >  ac_cv_lib_mpi_MPI_Init=no
4471   fi
4472 < rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
4473 < ac_cv_c_compiler_gnu=$ac_compiler_gnu
4474 <
4472 > rm -f core conftest.err conftest.$ac_objext \
4473 >    conftest$ac_exeext conftest.$ac_ext
4474 > LIBS=$ac_check_lib_save_LIBS
4475   fi
4476 < { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_c_compiler_gnu" >&5
4477 < $as_echo "$ac_cv_c_compiler_gnu" >&6; }
4478 < if test $ac_compiler_gnu = yes; then
4479 <  GCC=yes
5698 < else
5699 <  GCC=
4476 > { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpi_MPI_Init" >&5
4477 > $as_echo "$ac_cv_lib_mpi_MPI_Init" >&6; }
4478 > if test "x$ac_cv_lib_mpi_MPI_Init" = x""yes; then :
4479 >  MPILIBS="-lmpi"
4480   fi
4481 < ac_test_CFLAGS=${CFLAGS+set}
4482 < ac_save_CFLAGS=$CFLAGS
4483 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether $CC accepts -g" >&5
4484 < $as_echo_n "checking whether $CC accepts -g... " >&6; }
4485 < if test "${ac_cv_prog_cc_g+set}" = set; then :
4481 >
4482 > fi
4483 > if test x = x"$MPILIBS"; then
4484 >        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpich" >&5
4485 > $as_echo_n "checking for MPI_Init in -lmpich... " >&6; }
4486 > if test "${ac_cv_lib_mpich_MPI_Init+set}" = set; then :
4487    $as_echo_n "(cached) " >&6
4488   else
4489 <  ac_save_c_werror_flag=$ac_c_werror_flag
4490 <   ac_c_werror_flag=yes
4491 <   ac_cv_prog_cc_g=no
5711 <   CFLAGS="-g"
5712 <   cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4489 >  ac_check_lib_save_LIBS=$LIBS
4490 > LIBS="-lmpich  $LIBS"
4491 > cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4492   /* end confdefs.h.  */
4493  
4494 + /* Override any GCC internal prototype to avoid an error.
4495 +   Use char because int might match the return type of a GCC
4496 +   builtin and then its argument prototype would still apply.  */
4497 + #ifdef __cplusplus
4498 + extern "C"
4499 + #endif
4500 + char MPI_Init ();
4501   int
4502   main ()
4503   {
4504 <
4504 > return MPI_Init ();
4505    ;
4506    return 0;
4507   }
4508   _ACEOF
4509 < if ac_fn_c_try_compile "$LINENO"; then :
4510 <  ac_cv_prog_cc_g=yes
4509 > if ac_fn_c_try_link "$LINENO"; then :
4510 >  ac_cv_lib_mpich_MPI_Init=yes
4511   else
4512 <  CFLAGS=""
4513 <      cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4514 < /* end confdefs.h.  */
4512 >  ac_cv_lib_mpich_MPI_Init=no
4513 > fi
4514 > rm -f core conftest.err conftest.$ac_objext \
4515 >    conftest$ac_exeext conftest.$ac_ext
4516 > LIBS=$ac_check_lib_save_LIBS
4517 > fi
4518 > { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpich_MPI_Init" >&5
4519 > $as_echo "$ac_cv_lib_mpich_MPI_Init" >&6; }
4520 > if test "x$ac_cv_lib_mpich_MPI_Init" = x""yes; then :
4521 >  MPILIBS="-lmpich"
4522 > fi
4523  
4524 < int
5731 < main ()
5732 < {
4524 > fi
4525  
4526 <  ;
4527 <  return 0;
4528 < }
4529 < _ACEOF
5738 < if ac_fn_c_try_compile "$LINENO"; then :
5739 <
5740 < else
5741 <  ac_c_werror_flag=$ac_save_c_werror_flag
5742 <         CFLAGS="-g"
5743 <         cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4526 > if test x != x"$MPILIBS"; then
4527 >        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for mpi.h" >&5
4528 > $as_echo_n "checking for mpi.h... " >&6; }
4529 >        cat confdefs.h - <<_ACEOF >conftest.$ac_ext
4530   /* end confdefs.h.  */
4531 <
4531 > #include <mpi.h>
4532   int
4533   main ()
4534   {
# Line 5752 | Line 4538 | if ac_fn_c_try_compile "$LINENO"; then :
4538   }
4539   _ACEOF
4540   if ac_fn_c_try_compile "$LINENO"; then :
4541 <  ac_cv_prog_cc_g=yes
4541 >  { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
4542 > $as_echo "yes" >&6; }
4543 > else
4544 >  MPILIBS=""
4545 >                { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4546 > $as_echo "no" >&6; }
4547   fi
4548   rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
4549   fi
5759 rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
5760 fi
5761 rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
5762   ac_c_werror_flag=$ac_save_c_werror_flag
5763 fi
5764 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_prog_cc_g" >&5
5765 $as_echo "$ac_cv_prog_cc_g" >&6; }
5766 if test "$ac_test_CFLAGS" = set; then
5767  CFLAGS=$ac_save_CFLAGS
5768 elif test $ac_cv_prog_cc_g = yes; then
5769  if test "$GCC" = yes; then
5770    CFLAGS="-g -O2"
5771  else
5772    CFLAGS="-g"
5773  fi
5774 else
5775  if test "$GCC" = yes; then
5776    CFLAGS="-O2"
5777  else
5778    CFLAGS=
5779  fi
5780 fi
5781 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $CC option to accept ISO C89" >&5
5782 $as_echo_n "checking for $CC option to accept ISO C89... " >&6; }
5783 if test "${ac_cv_prog_cc_c89+set}" = set; then :
5784  $as_echo_n "(cached) " >&6
5785 else
5786  ac_cv_prog_cc_c89=no
5787 ac_save_CC=$CC
5788 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
5789 /* end confdefs.h.  */
5790 #include <stdarg.h>
5791 #include <stdio.h>
5792 #include <sys/types.h>
5793 #include <sys/stat.h>
5794 /* Most of the following tests are stolen from RCS 5.7's src/conf.sh.  */
5795 struct buf { int x; };
5796 FILE * (*rcsopen) (struct buf *, struct stat *, int);
5797 static char *e (p, i)
5798     char **p;
5799     int i;
5800 {
5801  return p[i];
5802 }
5803 static char *f (char * (*g) (char **, int), char **p, ...)
5804 {
5805  char *s;
5806  va_list v;
5807  va_start (v,p);
5808  s = g (p, va_arg (v,int));
5809  va_end (v);
5810  return s;
5811 }
4550  
4551 < /* OSF 4.0 Compaq cc is some sort of almost-ANSI by default.  It has
5814 <   function prototypes and stuff, but not '\xHH' hex character constants.
5815 <   These don't provoke an error unfortunately, instead are silently treated
5816 <   as 'x'.  The following induces an error, until -std is added to get
5817 <   proper ANSI mode.  Curiously '\x00'!='x' always comes out true, for an
5818 <   array size at least.  It's necessary to write '\x00'==0 to get something
5819 <   that's true only with -std.  */
5820 < int osf4_cc_array ['\x00' == 0 ? 1 : -1];
4551 > CC="$ax_mpi_save_CC"
4552  
5822 /* IBM C 6 for AIX is almost-ANSI by default, but it replaces macro parameters
5823   inside strings and character constants.  */
5824 #define FOO(x) 'x'
5825 int xlc6_cc_array[FOO(a) == 'x' ? 1 : -1];
4553  
5827 int test (int i, double x);
5828 struct s1 {int (*f) (int a);};
5829 struct s2 {int (*f) (double a);};
5830 int pairnames (int, char **, FILE *(*)(struct buf *, struct stat *, int), int, int);
5831 int argc;
5832 char **argv;
5833 int
5834 main ()
5835 {
5836 return f (e, argv, 0) != argv[0]  ||  f (e, argv, 1) != argv[1];
5837  ;
5838  return 0;
5839 }
5840 _ACEOF
5841 for ac_arg in '' -qlanglvl=extc89 -qlanglvl=ansi -std \
5842        -Ae "-Aa -D_HPUX_SOURCE" "-Xc -D__EXTENSIONS__"
5843 do
5844  CC="$ac_save_CC $ac_arg"
5845  if ac_fn_c_try_compile "$LINENO"; then :
5846  ac_cv_prog_cc_c89=$ac_arg
5847 fi
5848 rm -f core conftest.err conftest.$ac_objext
5849  test "x$ac_cv_prog_cc_c89" != "xno" && break
5850 done
5851 rm -f conftest.$ac_ext
5852 CC=$ac_save_CC
4554  
4555 < fi
4556 < # AC_CACHE_VAL
4557 < case "x$ac_cv_prog_cc_c89" in
4558 <  x)
4559 <    { $as_echo "$as_me:${as_lineno-$LINENO}: result: none needed" >&5
4560 < $as_echo "none needed" >&6; } ;;
4561 <  xno)
4562 <    { $as_echo "$as_me:${as_lineno-$LINENO}: result: unsupported" >&5
4563 < $as_echo "unsupported" >&6; } ;;
4564 <  *)
5864 <    CC="$CC $ac_cv_prog_cc_c89"
5865 <    { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_prog_cc_c89" >&5
5866 < $as_echo "$ac_cv_prog_cc_c89" >&6; } ;;
5867 < esac
5868 < if test "x$ac_cv_prog_cc_c89" != xno; then :
4555 > # Finally, execute ACTION-IF-FOUND/ACTION-IF-NOT-FOUND:
4556 > if test x = x"$MPILIBS"; then
4557 >        USE_MPI="no"
4558 >       { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: No suitable C MPI implementation found. openmd_MPI will not be built." >&5
4559 > $as_echo "$as_me: WARNING: No suitable C MPI implementation found. openmd_MPI will not be built." >&2;}
4560 >        :
4561 > else
4562 >        USE_MPI="yes"
4563 >        :
4564 > fi
4565  
4566 +
4567   fi
4568  
4569 < ac_ext=${ac_fc_srcext-f}
5873 < ac_compile='$FC -c $FCFLAGS $ac_fcflags_srcext conftest.$ac_ext >&5'
5874 < ac_link='$FC -o conftest$ac_exeext $FCFLAGS $LDFLAGS $ac_fcflags_srcext conftest.$ac_ext $LIBS >&5'
5875 < ac_compiler_gnu=$ac_cv_fc_compiler_gnu
4569 > if test $USE_MPI != no; then :
4570  
4571   ac_ext=${ac_fc_srcext-f}
4572   ac_compile='$FC -c $FCFLAGS $ac_fcflags_srcext conftest.$ac_ext >&5'
4573   ac_link='$FC -o conftest$ac_exeext $FCFLAGS $LDFLAGS $ac_fcflags_srcext conftest.$ac_ext $LIBS >&5'
4574   ac_compiler_gnu=$ac_cv_fc_compiler_gnu
5881 if test -n "$ac_tool_prefix"; then
5882  for ac_prog in $FC ifort ifc pathf95 pgf95 xlf95 lf95 epcf90 pathf90 xlf90 f95 f90 gfortran g95 fort
5883  do
5884    # Extract the first word of "$ac_tool_prefix$ac_prog", so it can be a program name with args.
5885 set dummy $ac_tool_prefix$ac_prog; ac_word=$2
5886 { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
5887 $as_echo_n "checking for $ac_word... " >&6; }
5888 if test "${ac_cv_prog_FC+set}" = set; then :
5889  $as_echo_n "(cached) " >&6
5890 else
5891  if test -n "$FC"; then
5892  ac_cv_prog_FC="$FC" # Let the user override the test.
5893 else
5894 as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
5895 for as_dir in $PATH
5896 do
5897  IFS=$as_save_IFS
5898  test -z "$as_dir" && as_dir=.
5899    for ac_exec_ext in '' $ac_executable_extensions; do
5900  if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
5901    ac_cv_prog_FC="$ac_tool_prefix$ac_prog"
5902    $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
5903    break 2
5904  fi
5905 done
5906  done
5907 IFS=$as_save_IFS
4575  
5909 fi
5910 fi
5911 FC=$ac_cv_prog_FC
5912 if test -n "$FC"; then
5913  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $FC" >&5
5914 $as_echo "$FC" >&6; }
5915 else
5916  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
5917 $as_echo "no" >&6; }
5918 fi
4576  
4577  
4578 <    test -n "$FC" && break
4579 <  done
4580 < fi
4581 < if test -z "$FC"; then
5925 <  ac_ct_FC=$FC
5926 <  for ac_prog in $FC ifort ifc pathf95 pgf95 xlf95 lf95 epcf90 pathf90 xlf90 f95 f90 gfortran g95 fort
4578 >
4579 >
4580 >
4581 >        for ac_prog in openmpif90 mpif90 mpxlf95_r mpxlf90_r mpxlf95 mpxlf90 mpf90 cmpif90c
4582   do
4583    # Extract the first word of "$ac_prog", so it can be a program name with args.
4584   set dummy $ac_prog; ac_word=$2
4585   { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
4586   $as_echo_n "checking for $ac_word... " >&6; }
4587 < if test "${ac_cv_prog_ac_ct_FC+set}" = set; then :
4587 > if test "${ac_cv_prog_MPIFC+set}" = set; then :
4588    $as_echo_n "(cached) " >&6
4589   else
4590 <  if test -n "$ac_ct_FC"; then
4591 <  ac_cv_prog_ac_ct_FC="$ac_ct_FC" # Let the user override the test.
4590 >  if test -n "$MPIFC"; then
4591 >  ac_cv_prog_MPIFC="$MPIFC" # Let the user override the test.
4592   else
4593   as_save_IFS=$IFS; IFS=$PATH_SEPARATOR
4594   for as_dir in $PATH
# Line 5942 | Line 4597 | do
4597    test -z "$as_dir" && as_dir=.
4598      for ac_exec_ext in '' $ac_executable_extensions; do
4599    if { test -f "$as_dir/$ac_word$ac_exec_ext" && $as_test_x "$as_dir/$ac_word$ac_exec_ext"; }; then
4600 <    ac_cv_prog_ac_ct_FC="$ac_prog"
4600 >    ac_cv_prog_MPIFC="$ac_prog"
4601      $as_echo "$as_me:${as_lineno-$LINENO}: found $as_dir/$ac_word$ac_exec_ext" >&5
4602      break 2
4603    fi
# Line 5952 | Line 4607 | fi
4607  
4608   fi
4609   fi
4610 < ac_ct_FC=$ac_cv_prog_ac_ct_FC
4611 < if test -n "$ac_ct_FC"; then
4612 <  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_ct_FC" >&5
4613 < $as_echo "$ac_ct_FC" >&6; }
4610 > MPIFC=$ac_cv_prog_MPIFC
4611 > if test -n "$MPIFC"; then
4612 >  { $as_echo "$as_me:${as_lineno-$LINENO}: result: $MPIFC" >&5
4613 > $as_echo "$MPIFC" >&6; }
4614   else
4615    { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4616   $as_echo "no" >&6; }
4617   fi
4618  
4619  
4620 <  test -n "$ac_ct_FC" && break
4620 >  test -n "$MPIFC" && break
4621   done
4622 + test -n "$MPIFC" || MPIFC="$FC"
4623  
4624 <  if test "x$ac_ct_FC" = x; then
4625 <    FC=""
5970 <  else
5971 <    case $cross_compiling:$ac_tool_warned in
5972 < yes:)
5973 < { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: using cross tools not prefixed with host triplet" >&5
5974 < $as_echo "$as_me: WARNING: using cross tools not prefixed with host triplet" >&2;}
5975 < ac_tool_warned=yes ;;
5976 < esac
5977 <    FC=$ac_ct_FC
5978 <  fi
5979 < fi
4624 >        ax_mpi_save_FC="$FC"
4625 >        FC="$MPIFC"
4626  
4627  
5982 # Provide some information about the compiler.
5983 $as_echo "$as_me:${as_lineno-$LINENO}: checking for Fortran compiler version" >&5
5984 set X $ac_compile
5985 ac_compiler=$2
5986 for ac_option in --version -v -V -qversion; do
5987  { { ac_try="$ac_compiler $ac_option >&5"
5988 case "(($ac_try" in
5989  *\"* | *\`* | *\\*) ac_try_echo=\$ac_try;;
5990  *) ac_try_echo=$ac_try;;
5991 esac
5992 eval ac_try_echo="\"\$as_me:${as_lineno-$LINENO}: $ac_try_echo\""
5993 $as_echo "$ac_try_echo"; } >&5
5994  (eval "$ac_compiler $ac_option >&5") 2>conftest.err
5995  ac_status=$?
5996  if test -s conftest.err; then
5997    sed '10a\
5998 ... rest of stderr output deleted ...
5999         10q' conftest.err >conftest.er1
6000    cat conftest.er1 >&5
6001    rm -f conftest.er1 conftest.err
6002  fi
6003  $as_echo "$as_me:${as_lineno-$LINENO}: \$? = $ac_status" >&5
6004  test $ac_status = 0; }
6005 done
6006 rm -f a.out
4628  
4629 < # If we don't use `.F' as extension, the preprocessor is not run on the
4630 < # input file.  (Note that this only needs to work for GNU compilers.)
4631 < ac_save_ext=$ac_ext
4632 < ac_ext=F
4633 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether we are using the GNU Fortran compiler" >&5
4634 < $as_echo_n "checking whether we are using the GNU Fortran compiler... " >&6; }
4635 < if test "${ac_cv_fc_compiler_gnu+set}" = set; then :
4629 > if test x = x"$MPILIBS"; then
4630 >        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init" >&5
4631 > $as_echo_n "checking for MPI_Init... " >&6; }
4632 >                        cat > conftest.$ac_ext <<_ACEOF
4633 >      program main
4634 >      call MPI_Init
4635 >      end
4636 > _ACEOF
4637 > if ac_fn_fc_try_link "$LINENO"; then :
4638 >  MPILIBS=" "
4639 >                                { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
4640 > $as_echo "yes" >&6; }
4641 > else
4642 >  { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4643 > $as_echo "no" >&6; }
4644 > fi
4645 > rm -f core conftest.err conftest.$ac_objext \
4646 >    conftest$ac_exeext conftest.$ac_ext
4647 > fi
4648 >
4649 >        if test x = x"$MPILIBS"; then
4650 >                { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lfmpi" >&5
4651 > $as_echo_n "checking for MPI_Init in -lfmpi... " >&6; }
4652 > if test "${ac_cv_lib_fmpi_MPI_Init+set}" = set; then :
4653    $as_echo_n "(cached) " >&6
4654   else
4655 <  cat > conftest.$ac_ext <<_ACEOF
4655 >  ac_check_lib_save_LIBS=$LIBS
4656 > LIBS="-lfmpi  $LIBS"
4657 > cat > conftest.$ac_ext <<_ACEOF
4658        program main
4659 < #ifndef __GNUC__
4660 <       choke me
4661 < #endif
4659 >      call MPI_Init
4660 >      end
4661 > _ACEOF
4662 > if ac_fn_fc_try_link "$LINENO"; then :
4663 >  ac_cv_lib_fmpi_MPI_Init=yes
4664 > else
4665 >  ac_cv_lib_fmpi_MPI_Init=no
4666 > fi
4667 > rm -f core conftest.err conftest.$ac_objext \
4668 >    conftest$ac_exeext conftest.$ac_ext
4669 > LIBS=$ac_check_lib_save_LIBS
4670 > fi
4671 > { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_fmpi_MPI_Init" >&5
4672 > $as_echo "$ac_cv_lib_fmpi_MPI_Init" >&6; }
4673 > if test "x$ac_cv_lib_fmpi_MPI_Init" = x""yes; then :
4674 >  MPILIBS="-lfmpi"
4675 > fi
4676  
4677 +        fi
4678 +        if test x = x"$MPILIBS"; then
4679 +                { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpichf90" >&5
4680 + $as_echo_n "checking for MPI_Init in -lmpichf90... " >&6; }
4681 + if test "${ac_cv_lib_mpichf90_MPI_Init+set}" = set; then :
4682 +  $as_echo_n "(cached) " >&6
4683 + else
4684 +  ac_check_lib_save_LIBS=$LIBS
4685 + LIBS="-lmpichf90  $LIBS"
4686 + cat > conftest.$ac_ext <<_ACEOF
4687 +      program main
4688 +      call MPI_Init
4689        end
4690   _ACEOF
4691 < if ac_fn_fc_try_compile "$LINENO"; then :
4692 <  ac_compiler_gnu=yes
4691 > if ac_fn_fc_try_link "$LINENO"; then :
4692 >  ac_cv_lib_mpichf90_MPI_Init=yes
4693   else
4694 <  ac_compiler_gnu=no
4694 >  ac_cv_lib_mpichf90_MPI_Init=no
4695   fi
4696 < rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
4697 < ac_cv_fc_compiler_gnu=$ac_compiler_gnu
4696 > rm -f core conftest.err conftest.$ac_objext \
4697 >    conftest$ac_exeext conftest.$ac_ext
4698 > LIBS=$ac_check_lib_save_LIBS
4699 > fi
4700 > { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpichf90_MPI_Init" >&5
4701 > $as_echo "$ac_cv_lib_mpichf90_MPI_Init" >&6; }
4702 > if test "x$ac_cv_lib_mpichf90_MPI_Init" = x""yes; then :
4703 >  MPILIBS="-lmpichf90"
4704 > fi
4705  
4706 +        fi
4707 +
4708 + if test x = x"$MPILIBS"; then
4709 +        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpi" >&5
4710 + $as_echo_n "checking for MPI_Init in -lmpi... " >&6; }
4711 + if test "${ac_cv_lib_mpi_MPI_Init+set}" = set; then :
4712 +  $as_echo_n "(cached) " >&6
4713 + else
4714 +  ac_check_lib_save_LIBS=$LIBS
4715 + LIBS="-lmpi  $LIBS"
4716 + cat > conftest.$ac_ext <<_ACEOF
4717 +      program main
4718 +      call MPI_Init
4719 +      end
4720 + _ACEOF
4721 + if ac_fn_fc_try_link "$LINENO"; then :
4722 +  ac_cv_lib_mpi_MPI_Init=yes
4723 + else
4724 +  ac_cv_lib_mpi_MPI_Init=no
4725   fi
4726 < { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_fc_compiler_gnu" >&5
4727 < $as_echo "$ac_cv_fc_compiler_gnu" >&6; }
4728 < ac_ext=$ac_save_ext
4729 < ac_test_FCFLAGS=${FCFLAGS+set}
4730 < ac_save_FCFLAGS=$FCFLAGS
4731 < FCFLAGS=
4732 < { $as_echo "$as_me:${as_lineno-$LINENO}: checking whether $FC accepts -g" >&5
4733 < $as_echo_n "checking whether $FC accepts -g... " >&6; }
4734 < if test "${ac_cv_prog_fc_g+set}" = set; then :
4726 > rm -f core conftest.err conftest.$ac_objext \
4727 >    conftest$ac_exeext conftest.$ac_ext
4728 > LIBS=$ac_check_lib_save_LIBS
4729 > fi
4730 > { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpi_MPI_Init" >&5
4731 > $as_echo "$ac_cv_lib_mpi_MPI_Init" >&6; }
4732 > if test "x$ac_cv_lib_mpi_MPI_Init" = x""yes; then :
4733 >  MPILIBS="-lmpi"
4734 > fi
4735 >
4736 > fi
4737 > if test x = x"$MPILIBS"; then
4738 >        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for MPI_Init in -lmpich" >&5
4739 > $as_echo_n "checking for MPI_Init in -lmpich... " >&6; }
4740 > if test "${ac_cv_lib_mpich_MPI_Init+set}" = set; then :
4741    $as_echo_n "(cached) " >&6
4742   else
4743 <  FCFLAGS=-g
4743 >  ac_check_lib_save_LIBS=$LIBS
4744 > LIBS="-lmpich  $LIBS"
4745   cat > conftest.$ac_ext <<_ACEOF
4746        program main
4747 +      call MPI_Init
4748 +      end
4749 + _ACEOF
4750 + if ac_fn_fc_try_link "$LINENO"; then :
4751 +  ac_cv_lib_mpich_MPI_Init=yes
4752 + else
4753 +  ac_cv_lib_mpich_MPI_Init=no
4754 + fi
4755 + rm -f core conftest.err conftest.$ac_objext \
4756 +    conftest$ac_exeext conftest.$ac_ext
4757 + LIBS=$ac_check_lib_save_LIBS
4758 + fi
4759 + { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpich_MPI_Init" >&5
4760 + $as_echo "$ac_cv_lib_mpich_MPI_Init" >&6; }
4761 + if test "x$ac_cv_lib_mpich_MPI_Init" = x""yes; then :
4762 +  MPILIBS="-lmpich"
4763 + fi
4764  
4765 + fi
4766 +
4767 + if test x != x"$MPILIBS"; then
4768 +        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for mpif.h" >&5
4769 + $as_echo_n "checking for mpif.h... " >&6; }
4770 +        cat > conftest.$ac_ext <<_ACEOF
4771 +      program main
4772 +      include 'mpif.h'
4773        end
4774   _ACEOF
4775   if ac_fn_fc_try_compile "$LINENO"; then :
4776 <  ac_cv_prog_fc_g=yes
4776 >  { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
4777 > $as_echo "yes" >&6; }
4778   else
4779 <  ac_cv_prog_fc_g=no
4779 >  MPILIBS=""
4780 >                { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
4781 > $as_echo "no" >&6; }
4782   fi
4783   rm -f core conftest.err conftest.$ac_objext conftest.$ac_ext
6057
4784   fi
4785 < { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_prog_fc_g" >&5
4786 < $as_echo "$ac_cv_prog_fc_g" >&6; }
4787 < if test "$ac_test_FCFLAGS" = set; then
4788 <  FCFLAGS=$ac_save_FCFLAGS
4789 < elif test $ac_cv_prog_fc_g = yes; then
4790 <  if test "x$ac_cv_fc_compiler_gnu" = xyes; then
4791 <    FCFLAGS="-g -O2"
4792 <  else
4793 <    FCFLAGS="-g"
4794 <  fi
4785 >
4786 > FC="$ax_mpi_save_FC"
4787 >
4788 >
4789 >
4790 > # Finally, execute ACTION-IF-FOUND/ACTION-IF-NOT-FOUND:
4791 > if test x = x"$MPILIBS"; then
4792 >        USE_MPI="no"
4793 >       { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: No suitable Fortran MPI implementation found. openmd_MPI will not be built." >&5
4794 > $as_echo "$as_me: WARNING: No suitable Fortran MPI implementation found. openmd_MPI will not be built." >&2;}
4795 >        :
4796   else
4797 <  if test "x$ac_cv_fc_compiler_gnu" = xyes; then
4798 <    FCFLAGS="-O2"
6072 <  else
6073 <    FCFLAGS=
6074 <  fi
4797 >        USE_MPI="yes"
4798 >        :
4799   fi
4800  
4801 < ac_ext=${ac_fc_srcext-f}
4802 < ac_compile='$FC -c $FCFLAGS $ac_fcflags_srcext conftest.$ac_ext >&5'
4803 < ac_link='$FC -o conftest$ac_exeext $FCFLAGS $LDFLAGS $ac_fcflags_srcext conftest.$ac_ext $LIBS >&5'
4804 < ac_compiler_gnu=$ac_cv_fc_compiler_gnu
4801 >
4802 > fi
4803 > if test $USE_MPI != no; then :
4804 >
4805 >        CXX=$MPICXX
4806 >        CC=$MPICC
4807 >        FC=$MPIFC
4808 >        LIBS="$MPILIBS $LIBS"
4809 >
4810 > else
4811 >
4812 >        CXX=$save_CXX
4813 >        CC=$save_CC
4814 >        FC=$save_FC
4815 >        LIBS=$save_LIBS
4816 >
4817 >
4818 > fi
4819  
4820 +
4821 + # Checks for programs.
4822   ac_ext=c
4823   ac_cpp='$CPP $CPPFLAGS'
4824   ac_compile='$CC -c $CFLAGS $CPPFLAGS conftest.$ac_ext >&5'
# Line 6696 | Line 5436 | esac
5436     x/*) ;;
5437     *) INSTALL=`pwd`/ac-tools/"shtool install -c" ;
5438   esac
5439 < MKINSTALLDIRS=`pwd`/ac-tools/"shtool mkdir -p -f"
5439 > MKINSTALLDIRS=`pwd`/ac-tools/"shtool mkdir -p -f -m 755"
5440   # Extract the first word of "ar", so it can be a program name with args.
5441   set dummy ar; ac_word=$2
5442   { $as_echo "$as_me:${as_lineno-$LINENO}: checking for $ac_word" >&5
# Line 8734 | Line 7474 | $as_echo "failed" >&6; }
7474                  echo ""
7475                  echo "*********************************************************"
7476                  echo "* WARNING: Could not find a working zlib installation   *"
7477 <                echo "* If you need OOPSE to be able to deal with compressed  *"
7477 >                echo "* If you need OpenMD to be able to deal with compressed *"
7478                  echo "* trajectory dump files be sure to specify a valid zlib *"
7479                  echo "* installation with --with-zlib=DIR                     *"
7480                  echo "*                                                       *"
7481 <                echo "* OOPSE will still work without zlib installed.         *"
7481 >                echo "* OpenMD will still work without zlib installed.        *"
7482                  echo "*********************************************************"
7483                  echo ""
7484          fi
# Line 9010 | Line 7750 | $as_echo "failed" >&6; }
7750              echo "* compute undulation spectra, be sure to specify a      *"
7751              echo "* valid fftw installation with --with-fftw=DIR          *"
7752              echo "*                                                       *"
7753 <            echo "* OOPSE will still work without fftw installed.         *"
7753 >            echo "* OpenMD will still work without fftw installed.        *"
7754              echo "*********************************************************"
7755              echo ""
7756            fi
# Line 9157 | Line 7897 | $as_echo "$as_me: WARNING: Could not find a working qh
7897   $as_echo "$as_me: WARNING: " >&2;}
7898             { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: Could not find a working qhull installation" >&5
7899   $as_echo "$as_me: WARNING: Could not find a working qhull installation" >&2;}
7900 <           { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: If you need OOPSE to be able to deal with convex    " >&5
7901 < $as_echo "$as_me: WARNING: If you need OOPSE to be able to deal with convex    " >&2;}
7900 >           { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: If you need OpenMD to be able to deal with convex    " >&5
7901 > $as_echo "$as_me: WARNING: If you need OpenMD to be able to deal with convex    " >&2;}
7902             { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: hulls be sure to specify a valid qhull installation " >&5
7903   $as_echo "$as_me: WARNING: hulls be sure to specify a valid qhull installation " >&2;}
7904             { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: with --with-qhull=DIR                               " >&5
7905   $as_echo "$as_me: WARNING: with --with-qhull=DIR                               " >&2;}
7906             { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: " >&5
7907   $as_echo "$as_me: WARNING: " >&2;}
7908 <           { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: OOPSE will still work without qhull installed.      " >&5
7909 < $as_echo "$as_me: WARNING: OOPSE will still work without qhull installed.      " >&2;}
7908 >           { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: OpenMD will still work without qhull installed.      " >&5
7909 > $as_echo "$as_me: WARNING: OpenMD will still work without qhull installed.      " >&2;}
7910             { $as_echo "$as_me:${as_lineno-$LINENO}: WARNING: " >&5
7911   $as_echo "$as_me: WARNING: " >&2;}
7912          fi
# Line 9440 | Line 8180 | $as_echo "failed" >&6; }
8180                  echo ""
8181                  echo "*********************************************************"
8182                  echo "* WARNING: Could not find a working openbabel-2.x       *"
8183 <                echo "* installation If you need OOPSE to be able to convert  *"
8183 >                echo "* installation If you need OpenMD to be able to convert *"
8184                  echo "* xyz or pdb files you need to specify a valid          *"
8185                  echo "* openbabel-2.x installation with --with-openbabel=DIR  *"
8186                  echo "*                                                       *"
8187 <                echo "* OOPSE will still work without openbabel installed.    *"
8187 >                echo "* OpenMD will still work without openbabel installed.   *"
8188                  echo "*********************************************************"
8189                  echo ""
8190          fi
# Line 10702 | Line 9442 | fi
9442   fi
9443  
9444       ;;
10705 esac
10706
10707
10708 acx_cgal_found=no
10709
10710 # Check whether --with-cgalmakefile was given.
10711 if test "${with_cgalmakefile+set}" = set; then :
10712  withval=$with_cgalmakefile;
10713 fi
10714
10715 case $with_cgalmakefile in
10716        yes | "") ;;
10717        no) acx_cgal_found=disable ;;
10718        -* | */* | *.a | *.so | *.so.* | *.o) CGAL_MAKEFILE="$with_cgalmakefile" ;;
10719        *) CGAL_MAKEFILE="$with_cgalmakefile" ;;
9445   esac
9446  
10722 if test "$acx_cgal_found" == no; then
10723    { $as_echo "$as_me:${as_lineno-$LINENO}: checking CGAL_MAKEFILE" >&5
10724 $as_echo_n "checking CGAL_MAKEFILE... " >&6; }
9447  
10726    if test \! -z "$CGAL_MAKEFILE"; then
10727
10728        if test -e "$CGAL_MAKEFILE"; then
10729            tname=`mktemp /tmp/cgal_makefile_dsrXXXXXX`
10730
10731 cat > $tname << _ACEOF
10732 include $CGAL_MAKEFILE
10733
10734 cppflags:
10735        @echo \$(CGAL_CXXFLAGS)
10736
10737 cxxflags:
10738        @echo
10739 ldflags:
10740        @echo \$(CGAL_LDFLAGS)
10741 _ACEOF
10742            CGAL_CPPFLAGS="`make -s -f $tname cppflags`"
10743            CGAL_CXXFLAGS="`make -s -f $tname cxxflags`"
10744            CGAL_LDFLAGST="`make -s -f $tname ldflags`"
10745            for i in $CGAL_LDFLAGST; do
10746                if test `echo $i| grep -c ^-l`; then
10747                    CGAL_LIBS="$CGAL_LIBS $i"
10748                else
10749                    CGAL_LDFLAGS="$CGAL_LDFLAGS $i"
10750                fi
10751            done
10752            rm -f $tname
10753            { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
10754 $as_echo "yes" >&6; }
10755            acx_cgal_found=yes
10756                                   else
10757            { $as_echo "$as_me:${as_lineno-$LINENO}: result: invalid" >&5
10758 $as_echo "invalid" >&6; }
10759            as_fn_error "CGAL_MAKEFILE defined, but the makefile does not exist." "$LINENO" 5
10760        fi
10761    else
10762        { $as_echo "$as_me:${as_lineno-$LINENO}: result: not defined" >&5
10763 $as_echo "not defined" >&6; }
10764    fi
10765 fi
10766
10767 if test "$acx_cgal_found" == no; then
10768        ac_fn_c_check_header_mongrel "$LINENO" "CGAL/Exact_predicates_inexact_constructions_kernel.h" "ac_cv_header_CGAL_Exact_predicates_inexact_constructions_kernel_h" "$ac_includes_default"
10769 if test "x$ac_cv_header_CGAL_Exact_predicates_inexact_constructions_kernel_h" = x""yes; then :
10770  cgal_have_header=yes
10771 else
10772  cgal_have_header=no
10773 fi
10774
10775
10776        if test "$cgal_have_header" == yes; then
10777                { $as_echo "$as_me:${as_lineno-$LINENO}: checking for main in -lCGAL" >&5
10778 $as_echo_n "checking for main in -lCGAL... " >&6; }
10779 if test "${ac_cv_lib_CGAL_main+set}" = set; then :
10780  $as_echo_n "(cached) " >&6
10781 else
10782  ac_check_lib_save_LIBS=$LIBS
10783 LIBS="-lCGAL  $LIBS"
10784 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
10785 /* end confdefs.h.  */
10786
10787
10788 #ifdef FC_DUMMY_MAIN
10789 #ifndef FC_DUMMY_MAIN_EQ_F77
10790 #  ifdef __cplusplus
10791     extern "C"
10792 #  endif
10793   int FC_DUMMY_MAIN() { return 1; }
10794 #endif
10795 #endif
10796 int
10797 main ()
10798 {
10799 return main ();
10800  ;
10801  return 0;
10802 }
10803 _ACEOF
10804 if ac_fn_c_try_link "$LINENO"; then :
10805  ac_cv_lib_CGAL_main=yes
10806 else
10807  ac_cv_lib_CGAL_main=no
10808 fi
10809 rm -f core conftest.err conftest.$ac_objext \
10810    conftest$ac_exeext conftest.$ac_ext
10811 LIBS=$ac_check_lib_save_LIBS
10812 fi
10813 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_CGAL_main" >&5
10814 $as_echo "$ac_cv_lib_CGAL_main" >&6; }
10815 if test "x$ac_cv_lib_CGAL_main" = x""yes; then :
10816  cgal_have_lib=yes
10817 else
10818  cgal_have_lib=no
10819 fi
10820
10821                if test "$cgal_have_lib" == no; then
10822                        save_LIBS="$LIBS"; LIBS="$LIBS -lgmp -lmpfr -lm"
10823                        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for main in -lCGAL" >&5
10824 $as_echo_n "checking for main in -lCGAL... " >&6; }
10825 if test "${ac_cv_lib_CGAL_main+set}" = set; then :
10826  $as_echo_n "(cached) " >&6
10827 else
10828  ac_check_lib_save_LIBS=$LIBS
10829 LIBS="-lCGAL  $LIBS"
10830 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
10831 /* end confdefs.h.  */
10832
10833
10834 #ifdef FC_DUMMY_MAIN
10835 #ifndef FC_DUMMY_MAIN_EQ_F77
10836 #  ifdef __cplusplus
10837     extern "C"
10838 #  endif
10839   int FC_DUMMY_MAIN() { return 1; }
10840 #endif
10841 #endif
10842 int
10843 main ()
10844 {
10845 return main ();
10846  ;
10847  return 0;
10848 }
10849 _ACEOF
10850 if ac_fn_c_try_link "$LINENO"; then :
10851  ac_cv_lib_CGAL_main=yes
10852 else
10853  ac_cv_lib_CGAL_main=no
10854 fi
10855 rm -f core conftest.err conftest.$ac_objext \
10856    conftest$ac_exeext conftest.$ac_ext
10857 LIBS=$ac_check_lib_save_LIBS
10858 fi
10859 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_CGAL_main" >&5
10860 $as_echo "$ac_cv_lib_CGAL_main" >&6; }
10861 if test "x$ac_cv_lib_CGAL_main" = x""yes; then :
10862  CGAL_LIBS="-lCGAL -lgmp -lmpfr"
10863                                                  cgal_have_lib=yes
10864 else
10865  cgal_have_lib=no
10866 fi
10867
10868                        LIBS="$save_LIBS"
10869                else
10870                        CGAL_LIBS="-lCGAL"
10871                        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for main in -lmpfr" >&5
10872 $as_echo_n "checking for main in -lmpfr... " >&6; }
10873 if test "${ac_cv_lib_mpfr_main+set}" = set; then :
10874  $as_echo_n "(cached) " >&6
10875 else
10876  ac_check_lib_save_LIBS=$LIBS
10877 LIBS="-lmpfr  $LIBS"
10878 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
10879 /* end confdefs.h.  */
10880
10881
10882 #ifdef FC_DUMMY_MAIN
10883 #ifndef FC_DUMMY_MAIN_EQ_F77
10884 #  ifdef __cplusplus
10885     extern "C"
10886 #  endif
10887   int FC_DUMMY_MAIN() { return 1; }
10888 #endif
10889 #endif
10890 int
10891 main ()
10892 {
10893 return main ();
10894  ;
10895  return 0;
10896 }
10897 _ACEOF
10898 if ac_fn_c_try_link "$LINENO"; then :
10899  ac_cv_lib_mpfr_main=yes
10900 else
10901  ac_cv_lib_mpfr_main=no
10902 fi
10903 rm -f core conftest.err conftest.$ac_objext \
10904    conftest$ac_exeext conftest.$ac_ext
10905 LIBS=$ac_check_lib_save_LIBS
10906 fi
10907 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_mpfr_main" >&5
10908 $as_echo "$ac_cv_lib_mpfr_main" >&6; }
10909 if test "x$ac_cv_lib_mpfr_main" = x""yes; then :
10910  CGAL_LIBS="$CGAL_LIBS -lmpfr"
10911 fi
10912
10913                        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for main in -lgmp" >&5
10914 $as_echo_n "checking for main in -lgmp... " >&6; }
10915 if test "${ac_cv_lib_gmp_main+set}" = set; then :
10916  $as_echo_n "(cached) " >&6
10917 else
10918  ac_check_lib_save_LIBS=$LIBS
10919 LIBS="-lgmp  $LIBS"
10920 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
10921 /* end confdefs.h.  */
10922
10923
10924 #ifdef FC_DUMMY_MAIN
10925 #ifndef FC_DUMMY_MAIN_EQ_F77
10926 #  ifdef __cplusplus
10927     extern "C"
10928 #  endif
10929   int FC_DUMMY_MAIN() { return 1; }
10930 #endif
10931 #endif
10932 int
10933 main ()
10934 {
10935 return main ();
10936  ;
10937  return 0;
10938 }
10939 _ACEOF
10940 if ac_fn_c_try_link "$LINENO"; then :
10941  ac_cv_lib_gmp_main=yes
10942 else
10943  ac_cv_lib_gmp_main=no
10944 fi
10945 rm -f core conftest.err conftest.$ac_objext \
10946    conftest$ac_exeext conftest.$ac_ext
10947 LIBS=$ac_check_lib_save_LIBS
10948 fi
10949 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_gmp_main" >&5
10950 $as_echo "$ac_cv_lib_gmp_main" >&6; }
10951 if test "x$ac_cv_lib_gmp_main" = x""yes; then :
10952  CGAL_LIBS="$CGAL_LIBS -lgmp"
10953 fi
10954
10955                        { $as_echo "$as_me:${as_lineno-$LINENO}: checking for main in -lgmpxx" >&5
10956 $as_echo_n "checking for main in -lgmpxx... " >&6; }
10957 if test "${ac_cv_lib_gmpxx_main+set}" = set; then :
10958  $as_echo_n "(cached) " >&6
10959 else
10960  ac_check_lib_save_LIBS=$LIBS
10961 LIBS="-lgmpxx  $LIBS"
10962 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
10963 /* end confdefs.h.  */
10964
10965
10966 #ifdef FC_DUMMY_MAIN
10967 #ifndef FC_DUMMY_MAIN_EQ_F77
10968 #  ifdef __cplusplus
10969     extern "C"
10970 #  endif
10971   int FC_DUMMY_MAIN() { return 1; }
10972 #endif
10973 #endif
10974 int
10975 main ()
10976 {
10977 return main ();
10978  ;
10979  return 0;
10980 }
10981 _ACEOF
10982 if ac_fn_c_try_link "$LINENO"; then :
10983  ac_cv_lib_gmpxx_main=yes
10984 else
10985  ac_cv_lib_gmpxx_main=no
10986 fi
10987 rm -f core conftest.err conftest.$ac_objext \
10988    conftest$ac_exeext conftest.$ac_ext
10989 LIBS=$ac_check_lib_save_LIBS
10990 fi
10991 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_gmpxx_main" >&5
10992 $as_echo "$ac_cv_lib_gmpxx_main" >&6; }
10993 if test "x$ac_cv_lib_gmpxx_main" = x""yes; then :
10994  CGAL_LIBS="$CGAL_LIBS -lgmpxx"
10995 fi
10996
10997                fi
10998
10999                if test "$cgal_have_lib" == yes; then
11000                        acx_cgal_found=yes
11001                fi
11002        fi
11003        if test "$acx_cgal_found" == yes; then
11004                { $as_echo "$as_me:${as_lineno-$LINENO}: checking for main in -lCore" >&5
11005 $as_echo_n "checking for main in -lCore... " >&6; }
11006 if test "${ac_cv_lib_Core_main+set}" = set; then :
11007  $as_echo_n "(cached) " >&6
11008 else
11009  ac_check_lib_save_LIBS=$LIBS
11010 LIBS="-lCore  $LIBS"
11011 cat confdefs.h - <<_ACEOF >conftest.$ac_ext
11012 /* end confdefs.h.  */
11013
11014
11015 #ifdef FC_DUMMY_MAIN
11016 #ifndef FC_DUMMY_MAIN_EQ_F77
11017 #  ifdef __cplusplus
11018     extern "C"
11019 #  endif
11020   int FC_DUMMY_MAIN() { return 1; }
11021 #endif
11022 #endif
11023 int
11024 main ()
11025 {
11026 return main ();
11027  ;
11028  return 0;
11029 }
11030 _ACEOF
11031 if ac_fn_c_try_link "$LINENO"; then :
11032  ac_cv_lib_Core_main=yes
11033 else
11034  ac_cv_lib_Core_main=no
11035 fi
11036 rm -f core conftest.err conftest.$ac_objext \
11037    conftest$ac_exeext conftest.$ac_ext
11038 LIBS=$ac_check_lib_save_LIBS
11039 fi
11040 { $as_echo "$as_me:${as_lineno-$LINENO}: result: $ac_cv_lib_Core_main" >&5
11041 $as_echo "$ac_cv_lib_Core_main" >&6; }
11042 if test "x$ac_cv_lib_Core_main" = x""yes; then :
11043  CGAL_LIBS="$CGAL_LIBS -lCore"
11044 fi
11045
11046        fi
11047 fi
11048
11049
11050
11051 { $as_echo "$as_me:${as_lineno-$LINENO}: checking CGAL" >&5
11052 $as_echo_n "checking CGAL... " >&6; }
11053
11054
11055
11056
11057
11058 if test "$acx_cgal_found" == yes; then
11059        { $as_echo "$as_me:${as_lineno-$LINENO}: result: yes" >&5
11060 $as_echo "yes" >&6; }
11061
11062 else
11063        { $as_echo "$as_me:${as_lineno-$LINENO}: result: no" >&5
11064 $as_echo "no" >&6; }
11065
11066 fi
11067 USE_CGAL=no
11068 if test "$acx_cgal_found" == yes; then
11069        USE_CGAL=yes
11070
11071 $as_echo "#define HAVE_CGAL 1" >>confdefs.h
11072
11073
11074
11075
11076
11077 fi
11078
11079
11080
11081
9448   # Check whether --enable-doxygen was given.
9449   if test "${enable_doxygen+set}" = set; then :
9450    enableval=$enable_doxygen;
# Line 11738 | Line 10104 | ac_log="
10104   # report actual input values of CONFIG_FILES etc. instead of their
10105   # values after options handling.
10106   ac_log="
10107 < This file was extended by OOPSE $as_me 4.0, which was
10108 < generated by GNU Autoconf 2.64.  Invocation command line was
10107 > This file was extended by OpenMD $as_me 1.0, which was
10108 > generated by GNU Autoconf 2.65.  Invocation command line was
10109  
10110    CONFIG_FILES    = $CONFIG_FILES
10111    CONFIG_HEADERS  = $CONFIG_HEADERS
# Line 11778 | Line 10144 | Usage: $0 [OPTION]... [TAG]...
10144  
10145    -h, --help       print this help, then exit
10146    -V, --version    print version number and configuration settings, then exit
10147 +      --config     print configuration, then exit
10148    -q, --quiet, --silent
10149                     do not print progress messages
10150    -d, --debug      don't remove temporary files
# Line 11797 | Line 10164 | cat >>$CONFIG_STATUS <<_ACEOF || ac_write_fail=1
10164  
10165   _ACEOF
10166   cat >>$CONFIG_STATUS <<_ACEOF || ac_write_fail=1
10167 + ac_cs_config="`$as_echo "$ac_configure_args" | sed 's/^ //; s/[\\""\`\$]/\\\\&/g'`"
10168   ac_cs_version="\\
10169 < OOPSE config.status 4.0
10170 < configured by $0, generated by GNU Autoconf 2.64,
10171 <  with options \\"`$as_echo "$ac_configure_args" | sed 's/^ //; s/[\\""\`\$]/\\\\&/g'`\\"
10169 > OpenMD config.status 1.0
10170 > configured by $0, generated by GNU Autoconf 2.65,
10171 >  with options \\"\$ac_cs_config\\"
10172  
10173   Copyright (C) 2009 Free Software Foundation, Inc.
10174   This config.status script is free software; the Free Software Foundation
# Line 11836 | Line 10204 | do
10204      ac_cs_recheck=: ;;
10205    --version | --versio | --versi | --vers | --ver | --ve | --v | -V )
10206      $as_echo "$ac_cs_version"; exit ;;
10207 +  --config | --confi | --conf | --con | --co | --c )
10208 +    $as_echo "$ac_cs_config"; exit ;;
10209    --debug | --debu | --deb | --de | --d | -d )
10210      debug=: ;;
10211    --file | --fil | --fi | --f )
# Line 12021 | Line 10391 | h
10391   t delim
10392   :nl
10393   h
10394 < s/\(.\{148\}\).*/\1/
10394 > s/\(.\{148\}\)..*/\1/
10395   t more1
10396   s/["\\]/\\&/g; s/^/"/; s/$/\\n"\\/
10397   p
# Line 12035 | Line 10405 | h
10405   t nl
10406   :delim
10407   h
10408 < s/\(.\{148\}\).*/\1/
10408 > s/\(.\{148\}\)..*/\1/
10409   t more2
10410   s/["\\]/\\&/g; s/^/"/; s/$/"/
10411   p

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