NAME¶

xtp_modify_jobfile - Part of the VOTCA package

SYNOPSIS¶

xtp_modify_jobfile [OPTIONS]

xtp_modify_jobfile [--help]

DESCRIPTION¶

Creates a subset Jobfile from a larger Jobfile using selection criteria

OPTIONS¶

options:

-h, --help show this help
message and exit
-i J_INPUT, --input J_INPUT Jobfile file to
select from.
-o J_OUTPUT, --output J_OUTPUT Filename to write
new jobfile to.
-l JOB_IDS [JOB_IDS ...], --job_ids JOB_IDS [JOB_IDS ...]
Either a list of ids
'1 3 5' or a range
'1-5' or a
combination thereof
-s SELECTOR, --selector SELECTOR A more flexible way
to select jobs can
be combined with
ranges. Specify the
xml tag you want
inside the job via
e.g. 'input/regions/
region.id:0'. The
tag must exist and
the value behind the
colon supports '?'
and '*' wildcards

AUTHORS¶

Written and maintained by the VOTCA Development Team <devs@votca.org>

COPYRIGHT¶

Copyright 2009-2021 The VOTCA Development Team (http://www.votca.org)

Licensed under the Apache License, Version 2.0 (the "License"); you may not use this file except in compliance with the License. You may obtain a copy of the License at

http://www.apache.org/licenses/LICENSE-2.0

Unless required by applicable law or agreed to in writing, software distributed under the License is distributed on an "AS IS" BASIS, WITHOUT WARRANTIES OR CONDITIONS OF ANY KIND, either express or implied. See the License for the specific language governing permissions and limitations under the License.