llnl / llnl/FAST

Where / how to get the pose files: *_ligand_pose_*.mol2

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Dominant language
Python
Stars
92
Forks
31
PR merge metrics
No merged PRs in 30d

Description

as tilte, thanks.

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.

Research direction

Start by reviewing the FAST repository for references to *_ligand_pose_*.mol2 and the code or documentation that consumes these pose files. Clarify where the files come from and document the retrieval or generation process, including the expected naming pattern.

Written by the indexing model from the issue text.

Assessment

Tech stack
python
Domain
documentation
Issue type
Documentation
Difficulty
2/5
Estimated time
1-3 hours
Activity status
Stale
Clarity
Needs clarification
Newbie friendliness
20/100

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