xtp_modify_jobfile(1)

xtp_modify_jobfile1

Part of the votca package

Usage

xtp_modify_jobfile [OPTIONS]

xtp_modify_jobfile [--help]

Overview

Creates a subset Jobfile from a larger Jobfile using selection criteria

Options

options:

-h, --help show this help message and exit
-i, --input J_INPUT Jobfile file to select from.
-o, --output J_OUTPUT Filename to write new jobfile to.
-l, --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 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

Releases

2 releases since Debian 12 (Bookworm); the text changed 1 time.

  1. 12
  2. 13

Authors

Written and maintained by the VOTCA Development Team <[email protected]>

From votca 2024.2-4 in Debian 13 (Trixie). Parsed by carta from the page's man source.