OpenFreeEnergy / OpenFreeEnergy/openfe
Add `close` method to ProtocolResult class
Open
Nobody has claimed this yet.
- Dominant language
- Python
- Stars
- 331
- Forks
- 56
- Avg merge
- 3d 9h
- Merged PRs (30d)
- 13
Description
Current implementation of the RBFE protocol opens a bunch of files but doesn't have an explicit way to close them (essentially just loop over the analyzers and close the reporters they are attached to).
Contributor guide
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
Start by locating the ProtocolResult class and tracing how the RBFE protocol creates analyzers and attaches reporters. Check how those reporters are currently opened and whether nearby lifecycle methods or tests define expected cleanup behavior. Done means ProtocolResult exposes close and closes the reporters attached to its analyzers.
Written by the indexing model from the issue text.
Assessment
- Tech stack
- python
- Domain
- backend
- Issue type
- Feature
- Difficulty
- 2/5
- Estimated time
- 1-3 hours
- Activity status
- Stale
- Clarity
- Mostly clear
- Newbie friendliness
- 45/100