mirror of
https://github.com/LCPQ/quantum_package
synced 2024-06-02 11:25:26 +02:00
391 lines
11 KiB
Bash
Executable File
391 lines
11 KiB
Bash
Executable File
#!/bin/bash
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#
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# Quantum Package configuration script
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#
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export QP_ROOT="$( cd "$(dirname "$0")" ; pwd -P )"
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echo "QP_ROOT="$QP_ROOT
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help()
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{
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cat <<EOF
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Quantum Package configuration script.
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Usage:
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configure -c <file> | --config <file>
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configure -h | --help
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configure -i <package> | --install <package>
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Options:
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-c <file>, --config <file> define a configuration file, in
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"${QP_ROOT}/config/".
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-h, --help print the help message
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-i <package>, --install <package> install <package>. Use at your own
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risk: no support will be provided
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for the installation of dependencies.
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Example:
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./configure -c config/gfortran.cfg
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Note:
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- Users are encouraged to create their own configuration files instead of
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modifying the existing ones.
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EOF
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exit
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}
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PACKAGES=""
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OCAML_PACKAGES="ocamlbuild cryptokit zmq core sexplib ppx_sexp_conv ppx_deriving getopt"
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while : ; do
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case "$1" in
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"")
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break;;
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-c|--config)
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CONFIG="$2"
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shift;;
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-i|--install)
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PACKAGES="${PACKAGE} $2"
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shift;;
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-h|-help|--help)
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help;;
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*)
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echo "unknown option $1, try --help"
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exit 2;;
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esac
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shift
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done
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# Trim leading and trailing spaces
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PACKAGES=$(echo $PACKAGES | xargs)
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echo "export QP_ROOT=\"$QP_ROOT\"" > ${QP_ROOT}/etc/00.qp_root.rc
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source quantum_package.rc
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function fail() {
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echo "Please refer to INSTALL.rst to install the missing dependencies."
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exit 1
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}
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function success() {
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echo ""
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echo "Configuration successful."
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exit 1
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}
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function error() {
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echo "Error : $1"
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exit 2
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}
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function download() {
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wget --no-check-certificate $1 --output-document=$2 || error "Unable to download $1"
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}
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function find_exe() {
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which $1 2> /dev/null || echo 'not_found'
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}
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function find_python_lib() {
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python2 -c "import $1" &> /dev/null && echo "$1" || echo 'not_found'
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}
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function find_lib() {
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echo "int main() { return 0; }" > "${QP_ROOT}"/external/tmp.c
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gcc $@ "${QP_ROOT}"/external/tmp.c -o "${QP_ROOT}"/external/tmp.exe 2> /dev/null
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if [[ -x "${QP_ROOT}"/external/tmp.exe ]] ; then
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rm "${QP_ROOT}"/external/tmp.exe "${QP_ROOT}"/external/tmp.c
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echo "$lib"
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else
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rm "${QP_ROOT}"/external/tmp.c
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echo "not_found"
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fi
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}
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function find_dir() {
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if [[ -d $1 ]] ; then
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echo "$1"
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else
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echo "not_found"
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fi
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}
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if [[ "${PACKAGES}.x" != ".x" ]] ; then
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echo ""
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echo "#########################################################"
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echo "# #"
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echo "# Automatic installation of dependencies #"
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echo "# #"
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echo "# USE AT YOUR OWN RISK : #"
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echo "# No support will be provided by the quantum package #"
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echo "# developers for the installation of external software. #"
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echo "# #"
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echo "# You may refer to the INSTALL.rst file for help. #"
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echo "# #"
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echo "#########################################################"
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echo ""
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fi
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if [[ ${PACKAGES} = all ]] ; then
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PACKAGES="ninja irpf90 zeromq f77zmq ocaml ezfio emsl docopt resultsFile bats"
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fi
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for PACKAGE in ${PACKAGES} ; do
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if [[ ${PACKAGE} = ninja ]] ; then
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download \
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"https://github.com/ninja-build/ninja/releases/download/v1.8.2/ninja-linux.zip" \
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"${QP_ROOT}"/external/ninja.zip
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unzip "${QP_ROOT}"/external/ninja.zip -d "${QP_ROOT}"/bin
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elif [[ ${PACKAGE} = irpf90 ]] ; then
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# When changing version of irpf90, don't forget to update etc/irpf90.rc
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download \
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"https://gitlab.com/scemama/irpf90/-/archive/v1.7.4/irpf90-v1.7.4.tar.gz" \
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"${QP_ROOT}"/external/irpf90.tar.gz
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(
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cd "${QP_ROOT}"/external
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tar --gunzip --extract --file irpf90.tar.gz
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rm irpf90.tar.gz
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cd irpf90-*
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make
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)
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elif [[ ${PACKAGE} = zeromq ]] ; then
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download \
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"https://github.com/zeromq/libzmq/releases/download/v4.2.5/zeromq-4.2.5.tar.gz" \
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"${QP_ROOT}"/external/zeromq.tar.gz
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(
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cd "${QP_ROOT}"/external
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tar --gunzip --extract --file zeromq.tar.gz
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rm zeromq.tar.gz
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cd zeromq-*
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./configure --prefix="$QP_ROOT" --without-libsodium --enable-libunwind=no
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make
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make install
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)
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elif [[ ${PACKAGE} = f77zmq ]] ; then
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download \
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"https://github.com/scemama/f77_zmq/archive/v4.2.5.tar.gz" \
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"${QP_ROOT}"/external/f77_zmq.tar.gz
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(
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cd "${QP_ROOT}"/external
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tar --gunzip --extract --file f77_zmq.tar.gz
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rm f77_zmq.tar.gz
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cd f77_zmq-*
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export ZMQ_H="$QP_ROOT"/include/zmq.h
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make
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cp libf77zmq.a "${QP_ROOT}"/lib
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cp libf77zmq.so "${QP_ROOT}"/lib
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cp f77_zmq_free.h "${QP_ROOT}"/include
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)
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elif [[ ${PACKAGE} = ocaml ]] ; then
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download \
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"https://raw.githubusercontent.com/ocaml/opam/master/shell/install.sh" \
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"${QP_ROOT}"/external/opam_installer.sh
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chmod +x "${QP_ROOT}"/external/opam_installer.sh
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rm --force ${QP_ROOT}/bin/opam
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if [[ -n ${TRAVIS} ]] ; then
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# Special commands for Travis CI
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export OPAMROOT=${HOME}/.opam
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cat << EOF | bash ${QP_ROOT}/external/opam_installer.sh --no-backup
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${QP_ROOT}/bin
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EOF
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else
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# Conventional commands
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export OPAMROOT=${OPAMROOT:-${QP_ROOT}/external/opam}
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echo "QP>> Please install it here: " ${QP_ROOT}/bin
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sh ${QP_ROOT}/external/opam_installer.sh
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fi
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source ${OPAMROOT}/opam-init/init.sh > /dev/null 2> /dev/null || true
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rm ${QP_ROOT}/external/opam_installer.sh
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${QP_ROOT}/bin/opam init --disable-sandboxing --verbose \
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--yes --comp=4.07.0
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eval $(${QP_ROOT}/bin/opam env)
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opam install -y ${OCAML_PACKAGES} || exit 1
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elif [[ ${PACKAGE} = ezfio ]] ; then
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download \
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"https://gitlab.com/scemama/EZFIO/-/archive/v1.3.4/EZFIO-v1.3.4.tar.gz" \
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"${QP_ROOT}"/external/ezfio.tar.gz
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(
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cd "${QP_ROOT}"/external
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tar --gunzip --extract --file ezfio.tar.gz
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mv EZFIO-* ezfio
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)
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elif [[ ${PACKAGE} = emsl ]] ; then
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download \
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"https://github.com/LCPQ/EMSL_Basis_Set_Exchange_Local/archive/v1.0.tar.gz" \
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"${QP_ROOT}"/external/EMSL.tar.gz
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(
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cd "${QP_ROOT}"/external
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tar --gunzip --extract --file EMSL.tar.gz
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mv EMSL_Basis* emsl
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)
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elif [[ ${PACKAGE} = docopt ]] ; then
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download \
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"https://github.com/docopt/docopt/archive/0.6.2.tar.gz" \
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"${QP_ROOT}"/external/docopt.tar.gz
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(
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cd "${QP_ROOT}"/external
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tar --gunzip --extract --file docopt.tar.gz
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mv docopt-*/docopt.py "${QP_ROOT}/external/Python"
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rm --recursive --force -- docopt-*/ docopt.tar.gz
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)
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elif [[ ${PACKAGE} = resultsFile ]] ; then
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download \
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"https://gitlab.com/scemama/resultsFile/-/archive/master/resultsFile-master.tar.gz" \
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"${QP_ROOT}"/external/resultsFile.tar.gz
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(
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cd "${QP_ROOT}"/external
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tar --gunzip --extract --file resultsFile.tar.gz
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mv resultsFile-master/resultsFile "${QP_ROOT}/external/Python"
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rm --recursive --force resultsFile-master resultsFile.tar.gz
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)
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elif [[ ${PACKAGE} = bats ]] ; then
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download \
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"https://github.com/bats-core/bats-core/archive/v1.1.0.tar.gz" \
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"${QP_ROOT}"/external/bats.tar.gz
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(
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cd "${QP_ROOT}"/external
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tar -zxf bats.tar.gz
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(
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cd bats-core-1.1.0/
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./install.sh $QP_ROOT
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)
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rm --recursive --force -- bats-core-1.1.0 \
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"${QP_ROOT}"/external/bats.tar.gz
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)
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fi
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done
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NINJA=$(find_exe ninja)
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if [[ ${NINJA} = not_found ]] ; then
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echo "ninja is not installed."
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fail
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fi
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IRPF90=$(find_exe irpf90)
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if [[ ${IRPF90} = not_found ]] ; then
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echo "irpf90 is not installed."
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fail
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fi
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ZEROMQ=$(find_lib -lzmq)
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if [[ ${ZEROMQ} = not_found ]] ; then
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echo "zeromq is not installed."
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fail
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fi
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F77ZMQ=$(find_lib -lzmq -lf77zmq)
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if [[ ${F77ZMQ} = not_found ]] ; then
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echo "Fortran binding of ZeroMQ (f77zmq) is not installed."
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fail
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fi
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OPAM=$(find_exe opam)
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if [[ ${OPAM} = not_found ]] ; then
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echo "OPAM (ocaml) package manager is not installed."
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fail
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fi
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OCAML=$(find_exe ocaml)
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if [[ ${OCAML} = not_found ]] ; then
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echo "OCaml compiler is not installed."
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fail
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fi
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EZFIO=$(find_dir "${QP_ROOT}"/external/ezfio)
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if [[ ${EZFIO} = not_found ]] ; then
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echo "ezfio is not installed."
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fail
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fi
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EMSL=$(find_dir "${QP_ROOT}"/external/emsl)
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if [[ ${EMSL} = not_found ]] ; then
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echo "emsl is not installed."
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fail
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fi
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DOCOPT=$(find_python_lib docopt)
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if [[ ${DOCOPT} = not_found ]] ; then
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echo "docopt is not installed."
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fail
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fi
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RESULTSFILE=$(find_python_lib resultsFile)
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if [[ ${RESULTSFILE} = not_found ]] ; then
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echo "resultsFile is not installed."
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fail
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fi
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echo " ___________________________ "
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echo "< All dependencies installed. >"
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echo " --------------------------- "
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echo " \ ^__^ "
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echo " \ (oo)\_______ "
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echo " (__)\ )\/\. "
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echo " ||----w | "
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echo " || || "
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echo "~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~~"
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echo ""
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echo "Now, if you want to use the current shell,"
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echo ""
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echo " source $QP_ROOT/quantum_package.rc"
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echo ""
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echo "Or if you want to use a Bash shell adapted for QP:"
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echo ""
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echo " $QP_ROOT/qpsh"
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echo ""
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if [[ -n $CONFIG ]] ; then
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"${QP_ROOT}"/scripts/compilation/qp_create_ninja create --development "${CONFIG}"
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fi
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