ReactionMechanismGenerator / ReactionMechanismGenerator/ARC
ARC Example Files Require Updating
Open
Nobody has claimed this yet.
Type: Bug
- Dominant language
- Python
- Stars
- 51
- Forks
- 25
- Avg merge
- 4d 5h
- Merged PRs (30d)
- 15
Description
Describe the bug
Example files such as minimal/bde/rate are out of date and do not run when called upon by ARC.
How to reproduce
Pull the main repo and then use ARC to run either minimal/bde/rate
Expected behavior
Expectations is that the run will complete without error
Contributor guide
No contributing guide indexed for this repository
First steps
- Read the whole issue, then the project's contributing guide.
- Comment on the issue to say you are picking it up — it saves two people doing the same work.
- Fork the repository and make your change on a branch.
- Open a pull request that references the issue number.
Research direction
Pull the main ARC repository and run ARC with the example files minimal/bde/rate to reproduce the failure. Inspect those examples and the ARC entry point used to run them, then update the examples so each run completes without error.
Written by the indexing model from the issue text.
Assessment
- Tech stack
- python
- Domain
- cli, tooling
- Issue type
- Bug
- Difficulty
- 3/5
- Estimated time
- 1-2 days
- Activity status
- Stale
- Clarity
- Mostly clear
- Newbie friendliness
- 35/100