sphuber / aiida-shell

AiiDA plugin that makes running shell commands easy.
MIT License
14 stars 7 forks source link

Add the `ShellCode` data plugin #20

Closed sphuber closed 2 years ago

sphuber commented 2 years ago

Fixes #3

The ShellCode data plugin is a subclass of the InstalledCode plugin from aiida-core. The new plugin is used by the launch_shell_job utility function whenever a code has to be created on the fly. This will serve to be able to query for these kinds of codes and to distinguish them from codes that are typically setup manually.