OpenFreeEnergy / OpenFreeEnergy/Lomap

Deprecate DBMolecules

Open
#149 8 comments 0 reactions 1 assignee View on GitHub

@IAlibay is already working on this.

Since Jun 11, 2026.

Dominant language
Python
Stars
45
Forks
16
Avg merge
55m
Merged PRs (30d)
1

Description

DBMolecules is poorly tested / documented, it might be a good idea to just remove it completely.

This issue is to gather opinions on doing this and see if there's anyone downstream that is relying on that utility.

Contributor guide

No contributing guide indexed for this repository

First steps

  1. Read the whole issue, then the project's contributing guide.
  2. Comment on the issue to say you are picking it up — it saves two people doing the same work.
  3. Fork the repository and make your change on a branch.
  4. Open a pull request that references the issue number.

Assessment

This issue has not been assessed yet.

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