mirror of
https://github.com/TREX-CoE/qmckl.git
synced 2024-08-25 14:41:46 +02:00
501 lines
14 KiB
Plaintext
501 lines
14 KiB
Plaintext
# -*- Autoconf -*-
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# Process this file with autoconf to produce a configure script.
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#
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# QMCkl - Quantum Monte Carlo kernel library
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#
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# BSD 3-Clause License
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#
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# Copyright (c) 2020, TREX Center of Excellence
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# All rights reserved.
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#
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# Redistribution and use in source and binary forms, with or without
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# modification, are permitted provided that the following conditions are met:
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#
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# 1. Redistributions of source code must retain the above copyright notice, this
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# list of conditions and the following disclaimer.
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#
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# 2. Redistributions in binary form must reproduce the above copyright notice,
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# this list of conditions and the following disclaimer in the documentation
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# and/or other materials provided with the distribution.
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#
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# 3. Neither the name of the copyright holder nor the names of its
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# contributors may be used to endorse or promote products derived from
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# this software without specific prior written permission.
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#
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# THIS SOFTWARE IS PROVIDED BY THE COPYRIGHT HOLDERS AND CONTRIBUTORS "AS IS"
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# AND ANY EXPRESS OR IMPLIED WARRANTIES, INCLUDING, BUT NOT LIMITED TO, THE
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# IMPLIED WARRANTIES OF MERCHANTABILITY AND FITNESS FOR A PARTICULAR PURPOSE ARE
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# DISCLAIMED. IN NO EVENT SHALL THE COPYRIGHT HOLDER OR CONTRIBUTORS BE LIABLE
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# FOR ANY DIRECT, INDIRECT, INCIDENTAL, SPECIAL, EXEMPLARY, OR CONSEQUENTIAL
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# DAMAGES (INCLUDING, BUT NOT LIMITED TO, PROCUREMENT OF SUBSTITUTE GOODS OR
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# SERVICES; LOSS OF USE, DATA, OR PROFITS; OR BUSINESS INTERRUPTION) HOWEVER
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# CAUSED AND ON ANY THEORY OF LIABILITY, WHETHER IN CONTRACT, STRICT LIABILITY,
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# OR TORT (INCLUDING NEGLIGENCE OR OTHERWISE) ARISING IN ANY WAY OUT OF THE USE
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# OF THIS SOFTWARE, EVEN IF ADVISED OF THE POSSIBILITY OF SUCH DAMAGE.
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AC_PREREQ([2.69])
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AC_INIT([qmckl],[0.3.1],[https://github.com/TREX-CoE/qmckl/issues],[],[https://trex-coe.github.io/qmckl/index.html])
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AC_CONFIG_AUX_DIR([tools])
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AM_INIT_AUTOMAKE([subdir-objects color-tests parallel-tests silent-rules 1.11])
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# Activate developer mode when the source is the git repository.
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# Otherwise, it is the source distribution and the developer mode should not be activated.
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AS_IF([test -d ${srcdir}/.git],
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[enable_maintainer_mode="yes"],
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[enable_maintainer_mode="no"]
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)
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AC_ARG_WITH(ifort, [AS_HELP_STRING([--with-ifort],[Use Intel Fortran compiler])], with_ifort=$withval, with_ifort=no)
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AS_IF([test "$with_ifort" == "yes"], [
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FC=ifort
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FCFLAGS="-march=native -ip -Ofast -ftz -finline -g -mkl=sequential" ])
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AC_ARG_WITH(icc, [AS_HELP_STRING([--with-icc],[Use Intel C compiler])], with_icc=$withval, with_icc=no)
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AS_IF([test "$with_icc" == "yes"], [
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CC=icc
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CFLAGS="-march=native -ip -Ofast -ftz -finline -g -mkl=sequential" ])
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AS_IF([test "$with_icc"."$with_ifort" == "yes.yes"], [
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ax_blas_ok="yes"
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ax_lapack_ok="yes"
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BLAS_LIBS=""
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LAPACK_LIBS=""])
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AM_PROG_AR
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AM_MAINTAINER_MODE()
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LT_INIT
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AC_CONFIG_SRCDIR([configure.ac])
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AC_CONFIG_HEADERS([include/config.h])
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AC_CONFIG_MACRO_DIR([m4])
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VERSION_MAJOR=`echo ${PACKAGE_VERSION} | cut -d. -f1`
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VERSION_MINOR=`echo ${PACKAGE_VERSION} | cut -d. -f2`
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VERSION_PATCH=`echo ${PACKAGE_VERSION} | cut -d. -f3 | cut -d- -f1`
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AC_DEFINE_UNQUOTED([QMCKL_VERSION_MAJOR], [$VERSION_MAJOR], [major version])
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AC_DEFINE_UNQUOTED([QMCKL_VERSION_MINOR], [$VERSION_MINOR], [minor version])
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AC_DEFINE_UNQUOTED([QMCKL_VERSION_PATCH], [$VERSION_PATCH], [patch version])
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AC_SUBST([VERSION_MAJOR])
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AC_SUBST([VERSION_MINOR])
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AC_SUBST([VERSION_PATCH])
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#AM_SILENT_RULES(yes)
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#AC_SUBST(SHARED_VERSION_INFO)
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#AC_ENABLE_SHARED([no]) dnl shared libs cause too many headaches to be default
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AC_LANG(C)
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# Checks for programs.
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AC_PROG_CC
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AC_PROG_F77
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# Make sure the c compiler supports C99
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m4_version_prereq([2.70],[], [AC_PROG_CC_C99])
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AS_IF([test "$ac_cv_prog_cc_c99" = "no"], [AC_MSG_ERROR([The compiler does not support C99])])
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AC_PROG_CC_C_O
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AM_PROG_CC_C_O
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AC_PROG_FC
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AC_PROG_FC_C_O
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AC_FC_PP_DEFINE
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AC_FC_SRCEXT([F90])
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AC_FC_FREEFORM
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LT_INIT
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AC_PROG_INSTALL
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AC_PROG_LN_S
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PKG_PROG_PKG_CONFIG([])
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PKG_LIBS=""
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PKG_CFLAGS=""
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# Checks for libraries.
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AC_FC_LIBRARY_LDFLAGS
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AC_CHECK_LIB([m], [sqrt])
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AC_CHECK_HEADERS([assert.h errno.h math.h pthread.h stdbool.h stdint.h stdio.h stdlib.h string.h])
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## pthread
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AC_CHECK_LIB([pthread], [pthread_create])
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# OpenMP
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AC_ARG_WITH(openmp, [AS_HELP_STRING([--with-openmp],[activate OpenMP])], with_omp=$withval, with_omp=no)
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if test "x$with_omp" = xyes; then
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AC_DEFINE([HAVE_OPENMP], [1], [Define to use OpenMP threading.])
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AX_OPENMP([],
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[AC_MSG_ERROR([Could not find OpenMP flags; configure with --without-openmp])])
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CFLAGS="${CFLAGS} ${OPENMP_CFLAGS}"
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FCFLAGS="${CFLAGS} ${OPENMP_FCFLAGS}"
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fi
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# CHAMELEON
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AC_ARG_WITH(chameleon,
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AS_HELP_STRING([--without-chameleon],
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[Do not use Chameleon. Default: auto-detect]), [
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case "$with_chameleon" in
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no)
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: ;;
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yes)
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PKG_CHECK_MODULES([LIBCHAMELEON],[chameleon >= 1.0.0],
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[PKG_CFLAGS="$PKG_CFLAGS $LIBCHAMELEON_CFLAGS"
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PKG_LIBS="$PKG_LIBS $LIBCHAMELEON_LIBS"]
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,[
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## something went wrong.
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## try to find the package without pkg-config
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## check that the library is actually new enough.
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## by testing for a 1.0.0+ function which we use
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AC_CHECK_LIB(chameleon,CHAMELEON_finalize,[LIBCHAMELEON_LIBS="-lchameleon"])
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])
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AH_TEMPLATE(HAVE_CHAMELEON,[Chameleon support is available])
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;;
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*)
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if test ! -d "$withval" ; then
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AC_MSG_ERROR([--with-chameleon path does not point to a directory])
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fi
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LIBCHAMELEON_LIBS="-L$with_chameleon/lib -lchameleon -lchameleon_starpu -lhqr -lcoreblas"
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LIBCHAMELEON_CFLAGS="-I$with_chameleon/include $CFLAGS"
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LIBCHAMELEON_CPPFLAGS="-I$with_chameleon/include $CPPFLAGS"
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esac
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])
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if test "x$LIBCHAMELEON_LIBS" != "x" ; then
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LIBS="$LIBS $LIBCHAMELEON_LIBS"
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CFLAGS="$CFLAGS $LIBCHAMELEON_CFLAGS"
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CPPFLAGS="$CPPFLAGS $LIBCHAMELEON_CPPFLAGS"
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AC_CHECK_HEADERS([chameleon.h], [], [AC_MSG_ERROR("chamelon.h not found")])
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AC_DEFINE_UNQUOTED([HAVE_CHAMELEON],1,[CHAMELEON support is available])
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fi
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#AS_IF([test "x$with_chameleon" != "xno"], [
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#])
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AC_MSG_NOTICE([CHAMELEON library support: ${with_CHAMELEON:=auto} ${LIBCHAMELEON_PATH} ${LIBCHAMELEON_LIBS}])
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# TREXIO
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AC_ARG_WITH(trexio, [AS_HELP_STRING([--without-trexio],[disable support for TREXIO])],
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with_trexio=$withval, with_trexio=yes)
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AS_IF([test "x$with_trexio" != xno], [
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AC_DEFINE([HAVE_TREXIO], [1], [Define if your have libtrexio])
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ARGS="${ARGS} trexio"
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AC_CHECK_LIB([trexio], [trexio_open],
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[],
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[AS_IF([test "x$with_trexio" != xcheck],
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[PKG_CHECK_MODULES([TREXIO], [trexio]) ])
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])
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])
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PKG_CFLAGS="$PKG_CFLAGS $TREXIO_CFLAGS"
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PKG_LIBS="$PKG_LIBS $TREXIO_LIBS"
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# QMCKL_DGEMM
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AC_ARG_WITH(qmckldgemm, [AS_HELP_STRING([--without-qmckldgemm],[disable support for QMCKLDGEMM])],
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with_qmckldgemm=$withval, with_qmckldgemm=no)
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AS_IF([test "x$with_qmckldgemm" != xno], [
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AC_DEFINE([HAVE_QMCKLDGEMM], [1], [Define if your have libqmckldgemm])
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ARGS="${ARGS} qmckldgemm"
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AC_CHECK_LIB([qmckldgemm], [qmckl_packed_matrix_create],
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[],
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[AS_IF([test "x$with_qmckldgemm" != xcheck],
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[PKG_CHECK_MODULES([QMCKLDGEMM], [qmckldgemm]) ])
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])
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])
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PKG_CFLAGS="$PKG_CFLAGS $QMCKLDGEMM_CFLAGS"
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PKG_LIBS="$PKG_LIBS $QMCKLDGEMM_LIBS"
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## BLAS
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AX_BLAS([], [AC_MSG_ERROR([BLAS was not found.])])
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## LAPACK
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AX_LAPACK([], [AC_MSG_ERROR([LAPACK was not found.])])
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AS_IF([test "$BLAS_LIBS" == "$LAPACK_LIBS"], [BLAS_LIBS=""])
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# Specific options required with some compilers
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case $FC in
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*ifort*)
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FCFLAGS="$FCFLAGS -nofor-main"
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;;
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*nvfortran*)
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FCFLAGS="$FCFLAGS -fPIC -Mnomain"
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;;
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esac
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case $CC in
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*gcc*)
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CFLAGS="$CFLAGS -fPIC"
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;;
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*nvc*)
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CFLAGS="$CFLAGS -fPIC"
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;;
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esac
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# Options.
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AC_ARG_ENABLE(hpc, [AS_HELP_STRING([--enable-hpc],[Use HPC-optimized functions])], HAVE_HPC=$enableval, HAVE_HPC=no)
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AS_IF([test "$HAVE_HPC" = "yes"], [
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AC_DEFINE([HAVE_HPC], [1], [If defined, activate HPC routines])
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])
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# Enable Verificarlo tests
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AC_ARG_ENABLE([vfc_ci],
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[ --enable-vfc_ci Build the library with vfc_ci support],
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[case "${enableval}" in
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yes) vfc_ci=true && FCFLAGS="-D VFC_CI $FCFLAGS" && CFLAGS="-D VFC_CI $CFLAGS";;
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no) vfc_ci=false ;;
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*) AC_MSG_ERROR([bad value ${enableval} for --enable_vfc_ci]) ;;
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esac],[vfc_ci=false])
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AM_CONDITIONAL([VFC_CI], [test x$vfc_ci = xtrue])
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if test "$FC" = "verificarlo-f"; then
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AC_MSG_NOTICE(verificarlo-f detected)
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# Arguments order is important here
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FCFLAGS="-Mpreprocess $FCFLAGS"
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fi
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## Enable GPU offloading
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# GPU offloading
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AC_ARG_ENABLE(gpu, [AS_HELP_STRING([--enable-gpu],[openmp|openacc : Use GPU-offloaded functions])], enable_gpu=$enableval, enable_gpu=no)
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AS_IF([test "$enable_gpu" = "yes"], [enable_gpu="openmp"])
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# OpenMP offloading
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HAVE_OPENMP_OFFLOAD="no"
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AS_IF([test "$enable_gpu" = "openmp"], [
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AC_DEFINE([HAVE_OPENMP_OFFLOAD], [1], [If defined, activate OpenMP-offloaded routines])
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HAVE_OPENMP_OFFLOAD="yes"
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case $CC in
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*gcc*)
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CFLAGS="$CFLAGS -fopenmp"
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;;
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*nvc*)
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CFLAGS="$CFLAGS -mp=gpu"
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;;
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esac
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case $FC in
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*gfortran*)
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FCFLAGS="$FCFLAGS -fopenmp"
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;;
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*nvfortran*)
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FCFLAGS="$FCFLAGS -mp=gpu"
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;;
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esac]
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)
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# OpenMP offloading
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HAVE_OPENACC_OFFLOAD="no"
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AS_IF([test "$enable_gpu" = "openacc"], [
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AC_DEFINE([HAVE_OPENACC_OFFLOAD], [1], [If defined, activate OpenACC-offloaded routines])
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HAVE_OPENACC_OFFLOAD="yes"
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case $CC in
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*gcc*)
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CFLAGS="$CFLAGS -fopenacc"
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;;
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*nvc*)
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CFLAGS="$CFLAGS -acc=gpu"
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;;
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esac
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case $FC in
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*gfortran*)
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FCFLAGS="$FCFLAGS -fopenacc"
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;;
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*nvfortran*)
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FCFLAGS="$FCFLAGS -acc=gpu"
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;;
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esac
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])
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# cuBLAS offloading
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AC_ARG_WITH(cublas, [AS_HELP_STRING([--with-cublas],[Use cuBLAS-offloaded functions])], HAVE_CUBLAS_OFFLOAD=$withval, HAVE_CUBLAS_OFFLOAD=no)
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AS_IF([test "$HAVE_CUBLAS_OFFLOAD" = "yes"], [
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AC_DEFINE([HAVE_CUBLAS_OFFLOAD], [1], [If defined, activate cuBLAS-offloaded routines])
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HAVE_OPENACC_OFFLOAD="yes"
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case $CC in
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*gcc*)
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CFLAGS="$CFLAGS -fopenmp"
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LDFLAGS="-lcublas"
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;;
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*nvc*)
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CFLAGS="$CFLAGS -mp=gpu -cudalib=cublas"
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;;
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esac
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case $FC in
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*gfortran*)
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FCFLAGS="$FCFLAGS -fopenmp"
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;;
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*nvfortran*)
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FCFLAGS="$FCFLAGS -mp=gpu -cudalib=cublas"
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;;
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esac
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])
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AC_ARG_ENABLE(malloc-trace, [AS_HELP_STRING([--enable-malloc-trace],[use debug malloc/free])], ok=$enableval, ok=no)
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if test "$ok" = "yes"; then
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AC_DEFINE(MALLOC_TRACE,"malloc_trace.dat",[Define to use debugging malloc/free])
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ARGS="${ARGS} malloc-trace"
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fi
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AC_ARG_ENABLE(prof, [AS_HELP_STRING([--enable-prof],[compile for profiling])], ok=$enableval, ok=no)
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if test "$ok" = "yes"; then
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CFLAGS="${CFLAGS} -pg"
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AC_DEFINE(ENABLE_PROF,1,[Define when using the profiler tool])
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ARGS="${ARGS} prof"
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fi
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AC_ARG_WITH(efence, [AS_HELP_STRING([--with-efence],[use ElectricFence library])], ok=$withval, ok=no)
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if test "$ok" = "yes"; then
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AC_CHECK_LIB([efence], [malloc])
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ARGS="${ARGS} efence"
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fi
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##
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AC_ARG_ENABLE(debug, [AS_HELP_STRING([--enable-debug],[compile for debugging])], ok=$enableval, ok=no)
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if test "$ok" = "yes"; then
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if test "$GCC" = "yes"; then
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CFLAGS="$CFLAGS \
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-g -Wall -W -Wbad-function-cast -Wcast-qual -Warray-bounds -Wdisabled-optimization \
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-fsanitize=address -fno-omit-frame-pointer \
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-Wpointer-arith -Wcast-align -Wpedantic -Wextra -Walloc-zero -Werror \
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"
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LDFLAGS="$LDFLAGS -fsanitize=address"
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fi
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if test "$GFC" = "yes"; then
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FCFLAGS="$FCFLAGS \
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-g -fcheck=all -Waliasing -Wampersand -Wconversion \
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-Wsurprising -ffpe-trap=zero,overflow,underflow \
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-Wintrinsics-std -Wno-tabs -Wintrinsic-shadow -Wline-truncation \
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-Wreal-q-constant -Wuninitialized -fbacktrace -finit-real=nan"
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fi
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if test "$FC" = "ifort"; then
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FCFLAGS="$FCFLAGS \
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-traceback -check all -debug all -fpe-all=0 -implicitnone"
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fi
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AC_DEFINE(DEBUG,1,[Define to turn on debugging checks])
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ARGS="${ARGS} debug"
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fi
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# Checks for header files.
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## qmckl
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AC_CHECK_HEADERS([inttypes.h malloc.h stdint.h stdlib.h string.h strings.h unistd.h])
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# Checks for typedefs, structures, and compiler characteristics.
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## qmckl
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AC_CHECK_HEADER_STDBOOL
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AC_TYPE_INT32_T
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AC_TYPE_INT64_T
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AC_TYPE_SIZE_T
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AC_TYPE_UINT32_T
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AC_TYPE_UINT64_T
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# Checks for library functions.
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## qmckl
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# AC_FUNC_MALLOC
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AC_CHECK_FUNCS([memset strerror])
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# Development mode
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if test "x$enable_maintainer_mode" == "xyes" ; then
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QMCKL_DEVEL=" -- Developer mode"
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else
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QMCKL_DEVEL=""
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fi
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AM_CONDITIONAL([QMCKL_DEVEL],[test "x$QMCKL_DEVEL" != x])
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if test "x${QMCKL_DEVEL}" != "x"; then
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AC_PROG_AWK
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AM_PATH_PYTHON
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AC_CHECK_PROGS([EMACS],[emacs26 emacs],[no])
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if test x${EMACS} == xno ; then
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AC_MSG_ERROR([
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--------------------------------------
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Error: Emacs is required for org-mode.
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--------------------------------------
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])
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fi
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AC_CHECK_PROGS([HAS_CPPCHECK],[cppcheck],[no])
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if test x${HAS_CPPCHECK} != xno ; then
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HAS_CPPCHECK=1
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fi
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AX_PKG_SWIG(4.0.0, [], AC_MSG_WARN([SWIG is required to build Python API.]) )
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fi
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#PKG-CONFIG
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#mkl-dynamic-lp64-seq
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PKG_LIBS="$PKG_LIBS $LIBS"
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LIBS="$BLAS_LIBS $LAPACK_LIBS $PKG_LIBS"
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CFLAGS="$CFLAGS $PKG_CFLAGS"
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AC_SUBST([PKG_LIBS])
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AC_SUBST([PKG_CFLAGS])
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AC_SUBST([HAS_CPPCHECK])
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AC_CONFIG_FILES([Makefile
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pkgconfig/qmckl.pc
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])
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AC_OUTPUT
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echo \
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"-------------------------------------------------
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${PACKAGE_NAME} Version ${PACKAGE_VERSION} ${QMCKL_DEVEL}
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Prefix: '${prefix}'.
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CC..............: ${CC}
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CPPFLAGS........: ${CPPFLAGS}
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CFLAGS..........: ${CFLAGS}
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FC..............: ${FC}
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FCFLAGS.........: ${FCFLAGS}
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LDFLAGS:........: ${LDFLAGS}
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LIBS............: ${LIBS}
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USE CHAMELEON...: ${with_chameleon}
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HPC version.....: ${HAVE_HPC}
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OpenMP offload..: ${HAVE_OPENMP_OFFLOAD}
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OpenACC offload.: ${HAVE_OPENACC_OFFLOAD}
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cuBLAS offload..: ${HAVE_CUBLAS_OFFLOAD}
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Package features:
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${ARGS}
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Now type 'make @<:@<target>@:>@'
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where the optional <target> is:
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all - build the library
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check - run tests
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install - install ${PACKAGE_NAME}
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--------------------------------------------------"
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