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mirror of https://github.com/QuantumPackage/qp2.git synced 2024-06-18 18:45:19 +02:00
qp2/etc/qp.rc

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# Configuration of the qp shell command
if [[ "$(ps -p $$ -ocomm=)" == "zsh" ]] ; then
autoload bashcompinit
bashcompinit
fi
source ${QP_ROOT}/etc/ezfio.rc
function _qp_usage()
{
cat << EOF
qp - Shell function of the qpsh shell
Usage:
EZFIO access:
qp set_file EZFIO_DIR Sets the current EZFIO directory.
qp unset_file Unsets the current EZFIO directory.
qp has <module> <parameter> If the <module>/<parameter> is set in the
EZFIO directory, returns 1. Otherwise returns 0.
qp get <module> <parameter> Returns the value of <module>/<parameter>.
qp set <module> <parameter> [<value>]
Sets the value of <module>/<parameter>. If the
value is not given in the command line it is read
from the standard input.
Running programs:
qp (run|srun|mpirun) <program>
qp stop
Getting help:
qp man (<program>|<qp_command>)
Running quantum package commands:
qp convert_output_to_ezfio
qp create_ezfio
qp plugins The corresponding commands start with "qp_".
qp reset To get help for a command <qp_command>, run
qp set_frozen_core <qp_command> --help
qp set_mo_class
qp update
EOF
}
function qp()
{
case $1 in
-h|--help)
_qp_usage ;;
"set_file")
if [[ -d ${2} ]] ; then
ezfio "$@"
else
>&2 echo "qp: ${2} not found"
fi;;
"unset_file")
unset EZFIO_FILE
;;
"has"|"set"|"get")
ezfio "$@"
;;
"create_ezfio")
shift
NAME=$(qp_create_ezfio "$@")
if [[ -d $NAME ]] ; then
[[ -d $EZFIO_FILE ]] && ezfio unset_file
ezfio set_file $NAME
else
qp_create_ezfio -h | more
fi
unset _ARGS
;;
"man")
shift
man $QP_ROOT/man/${1}.?
;;
"prompt")
shift
python3 $QP_ROOT/scripts/hello.py
function _check_ezfio() {
if [[ -d ${EZFIO_FILE} ]] ; then
printf "\e[0;32m|${EZFIO_FILE}>\e[m"
else
printf "\e[0;31m|${EZFIO_FILE}>\e[m"
fi
}
PS1="\$(_check_ezfio)\n$PS1"
;;
"plugins"|"update"|"convert_output_to_ezfio")
COMMAND='qp_$@'
eval "$COMMAND"
unset COMMAND
;;
"test")
shift
qp_test $@
;;
*)
which "qp_$1" &> /dev/null
if [[ $? -eq 0 ]] ; then
COMMAND='qp_$@'
eval "$COMMAND" "${EZFIO_FILE}"
result=$?
unset COMMAND
return $result
else
_qp_usage
fi
;;
esac
}
function _get_basis_sets () {
( qp_create_ezfio -b show \
| tr ' ' ':' \
| while IFS= read -r LINE ; do
printf '%s\n' ${LINE}
done
(cd ${QP_ROOT}/data/basis/ ; \ls)
) | sort | uniq
}
_qp_Complete()
{
local cur
COMPREPLY=()
cur="${COMP_WORDS[COMP_CWORD]}"
first="${COMP_WORDS[1]}"
prev="${COMP_WORDS[COMP_CWORD-1]}"
prev2="${COMP_WORDS[COMP_CWORD-2]}"
case "${first}" in
update)
COMPREPLY=( $(compgen -W "-h" -- $cur ) )
return 0
;;
man)
COMPREPLY=( $(compgen -W "$(cd ${QP_ROOT}/man ; \ls | sed 's/\.1//')" -- $cur ) )
return 0
;;
convert_output_to_ezfio)
COMPREPLY=( $(compgen -W "-o $(\ls)" -- ${cur} ) )
return 0
;;
create_ezfio)
case "${prev}" in
create_ezfio)
COMPREPLY=( $(compgen -W "-b -a -c -d -h -m -o -p -x $(\ls)" -- $cur ) )
return 0
;;
-m|-d|-c)
COMPREPLY=( $(compgen -W "" -- $cur ) )
return 0;;
-b)
COMPREPLY=( $(compgen -W "$(ls ${QP_ROOT}/data/basis)" -- $cur ) )
return 0
;;
-p)
COMPREPLY=( $(compgen -W "$(cd ${QP_ROOT}/data/pseudo ; \ls)" -- $cur ) )
return 0
;;
*)
COMPREPLY=( $(compgen -W "-b -a -c -d -h -m -o -p -x $(\ls)" -- $cur ) )
return 0
;;
esac;;
set_file)
# Array to store directory names
dirs=""
# Find directories containing "ezfio/.version" file recursively
for i in $(find . -name ezfio | sed 's/ezfio$/.version/')
do
dir_name=${i%/.version} # Remove the ".version" suffix
dir_name=${dir_name#./} # Remove the leading "./"
dirs+="./$dir_name "
done
COMPREPLY=( $(compgen -W "$dirs" -- ${cur} ) )
return 0
;;
plugins)
case "${prev}" in
plugins)
COMPREPLY=( $(compgen -W "list download install uninstall create" -- $cur ) )
return 0
;;
list)
COMPREPLY=( $(compgen -W "-i -u -q" -- $cur ) )
return 0;;
download)
COMPREPLY=( $(compgen -W "https://github.com/ https://gitlab.com/ git@github.com: git@gitlab.com: http:// https://" -- $cur ) )
return 0;;
install)
COMPREPLY=( $(compgen -W "$(qp_plugins list -u)" -- $cur ) )
return 0;;
uninstall)
COMPREPLY=( $(compgen -W "$(qp_plugins list -i)" -- $cur ) )
return 0;;
remove)
COMPREPLY=( $(compgen -W "$(qp_plugins list -i)" -- $cur ) )
return 0;;
create)
COMPREPLY=( $(compgen -W "-n " -- $cur ) )
return 0;;
*)
COMPREPLY=( $(compgen -W "$( \ls ; cd ${QP_ROOT}/src ; \ls )" -- $cur ) )
return 0
;;
esac;;
test)
COMPREPLY=( $(compgen -W "-v -a " -- $cur ) )
return 0
;;
*)
COMPREPLY=( $(compgen -W 'plugins set_file \
unset_file man \
create_ezfio \
test \
convert_output_to_ezfio \
-h update' -- $cur ) )
esac
if [[ -n ${EZFIO_FILE} && -d ${EZFIO_FILE} ]]
then
case "${prev2}" in
set|has|get)
if [[ ${prev} == "qp" ]] ; then
COMPREPLY=( $(compgen -W "plugins set reset set_frozen_core set_mo_class" -- $cur ) )
elif [[ ! -d ${EZFIO_FILE}/${prev} ]] ; then
COMPREPLY=( $(compgen -W "" -- $cur ) )
else
COMPREPLY=( $(compgen -W "$(cd ${EZFIO_FILE}/${prev} ; \ls | sed 's/\.gz//' )" -- $cur ) )
fi
return 0
;;
esac
case "${first}" in
run|srun|mpirun)
COMPREPLY=( $(compgen -W "-h $(cat ${QP_ROOT}/data/executables | cut -d ' ' -f 1)" -- $cur ) )
return 0
;;
reset)
COMPREPLY=( $(compgen -W "-h -m -a -d" -- $cur ) )
return 0
;;
unset_file|set_frozen_core)
COMPREPLY=()
return 0
;;
set_mo_class)
COMPREPLY=( $(compgen -W "-h -c -i -a -v -d -q" -- $cur ) )
return 0
;;
set|has|get)
COMPREPLY=( $(compgen -W "$(cd ${EZFIO_FILE} ; \ls -d */ | sed 's|/||g')" -- $cur ) )
return 0
;;
edit)
COMPREPLY=( $(compgen -W "-h -c -n -s" -- $cur ) )
return 0
;;
*)
COMPREPLY+=( $(compgen -W 'has get set edit \
run srun mpirun set_frozen_core \
reset set_mo_class ' \
-- $cur ) )
return 0
;;
esac
fi
}
complete -F _qp_Complete qp