aiida-core
https://github.com/aiidateam/aiida-core
Python
The official repository for the AiiDA code
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- Issues
- Docs: Improve color palette consistency of documentation
- Extending the PostgreSQL database with custom tables
- Enhance attributes of codes?
- Performance of `Group.add_nodes` and `Group.remove_nodes` is abysmal
- Change the spec of `objects.get_or_create` to only return the instance not a tuple
- Replace existing pytest based CLI tests to use `run_cli_command` fixture
- Duplicate CREATE links when importing old export file
- Docs: Check for duplications.
- DOCS: Add to intro/about section
- DOCS: provenance graph to highlight nodes of specified datastructure class
- Docs
- Python not yet supported