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https://github.com/TREX-CoE/qmckl.git
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Improve configure
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parent
eba2873316
commit
8c388a93b7
214
configure.ac
214
configure.ac
@ -178,58 +178,60 @@ fi
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# TREXIO
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LIBTREXIO=
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AC_ARG_WITH([trexio],
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[AS_HELP_STRING([--without-trexio],
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[disable support for TREXIO])],
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[with_trexio=$withval],
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[with_trexio=yes])
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case "$with_trexio" in
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no)
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: ;;
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yes)
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AC_CHECK_LIB([trexio], [trexio_open], [],
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AS_CASE([$with_trexio],
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[no], [],
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[yes],
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[AC_CHECK_LIB([trexio], [trexio_open], [],
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[PKG_CHECK_MODULES([TREXIO], [trexio]) ])
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AC_CHECK_HEADERS([trexio.h], [],
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[AC_MSG_ERROR("trexio.h not found")])
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AC_DEFINE([HAVE_TREXIO], [1], [Define if TREXIO support is available])
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ARGS="${ARGS} trexio"
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;;
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*)
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if test ! -d "$withval" ; then
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AC_MSG_ERROR([--with-trexio=$withval: argument is not a directory])
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fi
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ARGS="${ARGS} trexio"],
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[AS_IF([test ! -d "$withval"],
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[AC_MSG_ERROR([--with-trexio=$withval: argument is not a directory])])
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TREXIO_LIBS="-L$with_trexio/lib -ltrexio"
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TREXIO_CFLAGS="-I$with_trexio/include"
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AC_CHECK_HEADERS([trexio.h], [],
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[AC_MSG_ERROR("trexio.h not found")])
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AC_DEFINE([HAVE_TREXIO], [1], [Define if TREXIO support is available])
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ARGS="${ARGS} trexio"
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;;
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esac
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])
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PKG_CFLAGS="$PKG_CFLAGS $TREXIO_CFLAGS"
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PKG_LIBS="$PKG_LIBS $TREXIO_LIBS"
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# QMCKL_DGEMM
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# QMCKLDGEMM
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AC_ARG_WITH([qmckldgemm],
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[AS_HELP_STRING([--with-qmckldgemm],
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[enable support for the QMCKLDGEMM library])],
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with_qmckldgemm=$withval,
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with_qmckldgemm=no)
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[enable support for QMCKL DGEMM])],
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[with_qmckldgemm=$withval],
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[with_qmckldgemm=no])
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#AS_IF([test "x$with_qmckldgemm" != xno], [
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# [ARGS="${ARGS} qmckldgemm"
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# AC_CHECK_LIB([qmckldgemm], [qmckl_packed_matrix_create], [],
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# [AS_IF([test "x$with_qmckldgemm" != xcheck],
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# [PKG_CHECK_MODULES([QMCKLDGEMM], [qmckldgemm]) ])])],
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# [AC_DEFINE([HAVE_QMCKLDGEMM], [1], [Define if QMCKLDGEMM is used])]
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#)
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AS_CASE([$with_qmckldgemm],
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[no], [],
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[yes],
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[AC_CHECK_LIB([qmckldgemm], [qmckl_packed_matrix_create], [],
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[PKG_CHECK_MODULES([QMCKLDGEMM], [qmckldgemm]) ])
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# AC_CHECK_HEADERS([qmckldgemm.h], [],
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# [AC_MSG_ERROR("qmckldgemm.h not found")])
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AC_DEFINE([HAVE_QMCKLDGEMM], [1], [Define if QMCKL DGEMM support is available])
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ARGS="${ARGS} qmckldgemm"],
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[AS_IF([test ! -d "$withval"],
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[AC_MSG_ERROR([--with-qmckldgemm=$withval: argument is not a directory])])
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QMCKLDGEMM_LIBS="-L$with_qmckldgemm/lib -lqmckldgemm"
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QMCKLDGEMM_CFLAGS="-I$with_qmckldgemm/include"
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# AC_CHECK_HEADERS([qmckldgemm.h], [],
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# [AC_MSG_ERROR("qmckldgemm.h not found")])
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AC_DEFINE([HAVE_QMCKLDGEMM], [1], [Define if QMCKL DGEMM support is available])
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ARGS="${ARGS} qmckldgemm"
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])
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#PKG_CFLAGS="$PKG_CFLAGS $QMCKLDGEMM_CFLAGS"
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#PKG_LIBS="$PKG_LIBS $QMCKLDGEMM_LIBS"
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## BLAS
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AX_BLAS([], [AC_MSG_ERROR([BLAS was not found.])])
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@ -240,27 +242,15 @@ AS_IF([test "$BLAS_LIBS" = "$LAPACK_LIBS"], [BLAS_LIBS=""])
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# Specific options required with some compilers
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case $FC in
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AS_CASE([$FC],
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[*ifort*], [FCFLAGS="$FCFLAGS -nofor-main"],
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[*nvfortran*], [FCFLAGS="$FCFLAGS -fPIC -Mnomain"],
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[])
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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="$CFLAGS -fPIC"
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;;
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esac
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AS_CASE([$CC],
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[*gcc*], [CFLAGS="$CFLAGS -fPIC"],
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[*nvc*], [CFLAGS="$CFLAGS -fPIC"],
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[])
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# Options
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@ -306,25 +296,15 @@ 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="$FCFLAGS -mp=gpu"
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;;
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esac]
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AS_CASE([$CC],
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[*gcc*], [CFLAGS="$CFLAGS -fopenmp"],
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[*nvc*], [CFLAGS="$CFLAGS -mp=gpu"],
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[])
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AS_CASE([$FC],
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[*gfortran*], [FCFLAGS="$FCFLAGS -fopenmp"],
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[*nvfortran*], [FCFLAGS="$FCFLAGS -mp=gpu"],
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[])
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]
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)
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# OpenMP offloading
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@ -332,25 +312,15 @@ HAVE_OPENACC_OFFLOAD="no"
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AS_IF([test "$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="$FCFLAGS -acc=gpu"
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;;
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esac
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AS_CASE([$CC],
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[*gcc*], [CFLAGS="$CFLAGS -fopenacc"],
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[*nvc*], [CFLAGS="$CFLAGS -acc=gpu"],
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[])
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AS_CASE([$FC],
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[*gfortran*], [FCFLAGS="$FCFLAGS -fopenacc"],
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[*nvfortran*], [FCFLAGS="$FCFLAGS -acc=gpu"],
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[])
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]
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])
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@ -359,75 +329,65 @@ AC_ARG_WITH(cublas, [AS_HELP_STRING([--with-cublas],[Use cuBLAS-offloaded functi
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AS_IF([test "$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="$FCFLAGS -mp=gpu -cudalib=cublas"
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;;
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esac
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AS_CASE([$CC],
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[*gcc*], [CFLAGS="$CFLAGS -fopenmp"
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LDFLAGS="-lcublas"],
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[*nvc*], [CFLAGS="$CFLAGS -mp=gpu -cudalib=cublas"],
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[])
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AS_CASE([$FC],
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[*gfortran*], [FCFLAGS="$FCFLAGS -fopenmp"],
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[*nvfortran*], [FCFLAGS="$FCFLAGS -mp=gpu -cudalib=cublas"],
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[])
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]
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])
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AC_ARG_ENABLE(malloc-trace, [AS_HELP_STRING([--enable-malloc-trace],[use debug malloc/free])], ok=$enableval, ok=no)
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if test "$ok" = "yes"; then
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AS_IF([test "$ok" = "yes"], [
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AC_DEFINE(MALLOC_TRACE,"malloc_trace.dat",[Define to use debugging malloc/free])
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ARGS="${ARGS} malloc-trace"
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fi
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])
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AC_ARG_ENABLE(prof, [AS_HELP_STRING([--enable-prof],[compile for profiling])], ok=$enableval, ok=no)
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if test "$ok" = "yes"; then
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AS_IF([test "$ok" = "yes"], [
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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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])
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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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AS_IF([test "$ok" = "yes"], [
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AC_CHECK_LIB([efence], [malloc])
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ARGS="${ARGS} efence"
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fi
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])
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##
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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 "$GCC" = "yes"; then
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AS_IF([test "$ok" = "yes"], [
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AS_IF([test "$GCC" = "yes"], [
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CFLAGS="$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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])
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AS_IF([test "$GFC" = "yes"], [
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FCFLAGS="$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 "$FC" = "ifort"; then
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])
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AS_IF([test "$FC" = "ifort"], [
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FCFLAGS="$FCFLAGS \
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-traceback -check all -debug all -fpe-all=0 -implicitnone"
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fi
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])
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AC_DEFINE(DEBUG,1,[Define to turn on debugging checks])
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ARGS="${ARGS} debug"
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fi
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])
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# Checks for header files.
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@ -452,16 +412,13 @@ AC_TYPE_UINT64_T
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AC_CHECK_FUNCS([memset strerror])
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# Development mode
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if test "x$enable_maintainer_mode" = "xyes" ; then
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QMCKL_DEVEL=" -- Developer mode"
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else
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QMCKL_DEVEL=""
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fi
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QMCKL_DEVEL=
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AS_IF([test "x$enable_maintainer_mode" = "xyes"],
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[QMCKL_DEVEL=" -- Developer mode"])
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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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AS_IF([test "x${QMCKL_DEVEL}" != "x"], [
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AC_PROG_AWK
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AM_PATH_PYTHON
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@ -477,8 +434,7 @@ if test "x${QMCKL_DEVEL}" != "x"; then
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AS_IF([test "x${HAS_CPPCHECK}" != "xno"], [HAS_CPPCHECK=1])
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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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])
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#PKG-CONFIG
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