--- configure.ac.old 2010-04-08 10:22:02.000000000 -0700
+++ configure.ac 2010-04-08 10:34:40.000000000 -0700
@@ -13,6 +13,7 @@
AC_DEFINE([LIBVERSION], ["2.99.1"], [This is the version of libghemical to be built--it is set in the configure.ac])
AC_SUBST([LIBVERSION], ["2.99.1"])
+AC_CONFIG_MACRO_DIR([m4])
##################################################################
## also see src/Makefile.am when you change the version number!!!
@@ -121,7 +122,12 @@
AC_CHECK_LIB([m], [acos],, AC_MSG_ERROR([math library missing]))
if test $enable_mpqc = yes; then
- AC_CHECK_LIB([blas], [main],, AC_MSG_ERROR([Cannot find blas library needed for MPQC support]))
+ AC_CHECK_LIB([blas], [main],,
+ [
+ LDFLAGS="$LDFLAGS $ATLASLIBDIR"
+ AC_CHECK_LIB([f77blas], [main],LIBS="-latlas $LIBS",
+ AC_MSG_ERROR([Cannot find blas library needed for MPQC support]))
+ ])
AC_CHECK_LIB([lapack], [main],, AC_MSG_ERROR([Cannot find lapack library needed for MPQC support]))
AM_PATH_SC(1.2.5, HAVE_MPQC="yes", HAVE_MPQC="no")
if test "${HAVE_MPQC}" = "yes"; then
@@ -130,21 +136,21 @@
AC_DEFINE_UNQUOTED([SC_MINOR_VERSION], [$SC_MINOR_VERSION], [This is the minor version of SC (MPQC's underlying library) found by configure])
AC_DEFINE_UNQUOTED([SC_MICRO_VERSION], [$SC_MICRO_VERSION], [This is the micro version of SC (MPQC's underlying library) found by configure])
CPPFLAGS="$CPPFLAGS $SC_CPPFLAGS"
- LIBS="$LIBS $SC_LIBS"
+ LIBS="$LIBS $SC_LIBS -lmpqc -lSCbasis -lSCcints -lSCclass -lSCcontainer -lSCdft -lSCgroup -lSCintv3 -lSCisosurf -lSCkeyval -lSCmbpt -lSCmbptr12 -lSCmisc -lSCmolecule -lSCoint3 -lSCoptimize -lSCoptions -lSCpsi -lSCref -lSCrender -lSCscf -lSCscmat -lSCsolvent -lSCstate -lSCsymmetry -lSCwfn"
else AC_MSG_ERROR([Cannot find proper SC version])
fi
fi
if test $enable_mopac7 = yes; then
AC_DEFINE([ENABLE_MOPAC7],, [Define if you are building a version that interfaces directly with MOPAC7])
-
+
PKG_CHECK_MODULES([MOPAC7], [libmopac7 >= 1.13])
##alt MOPAC7_CFLAGS=`$PKG_CONFIG --cflags libmopac7`
##alt MOPAC7_LIBS=`$PKG_CONFIG --libs libmopac7`
-
+
CPPFLAGS="$CPPFLAGS $MOPAC7_CFLAGS"
LIBS="$LIBS $MOPAC7_LIBS"
-
+
REQUISITIONS="$REQUISITIONS libmopac7"
fi
