custom_params Command Help

Command: $SCHRODINGER/utilities/custom_params

usage: custom_params [-h] <task> ...

Utility script used to upgrade and merge custom OPLS parameters.

Copyright Schrodinger LLC, All Rights Reserved.

positional arguments:
  <task>
    upgrade   Upgrade OPLS archive for use in the current release. If a single
              directory path is passed, input and output files take the
              canonical OPLSDIR format, i.e., custom_YYYY_Q.opls. Otherwise,
              requires both the input and output .opls file paths (of any
              names).
    merge     Merge parameters from an alternate OPLSDIR into a primary
              OPLSDIR.

options:
  -h, --help  show this help message and exit

To get help messages for different tasks, run $SCHRODINGER/utilities/custom_params <task> -h