OpenFreeEnergy / OpenFreeEnergy/openfe

Discuss `restarts`

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Dominant language
Python
Stars
331
Forks
56
Avg merge
3d 9h
Merged PRs (30d)
13

Description

There is a strong use case to restarting a job that was preempted. We should work out how to implement this (although it's probably a gufe thing).

Contributor guide

Open the contributing guide

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 issue's proposed use case for restarting a preempted job and determine whether the behavior belongs in openfe or gufe. Trace the existing job and preemption flow, then define the implementation scope and acceptance criteria for a restartable job before coding.

Written by the indexing model from the issue text.

Assessment

Tech stack
python
Domain
backend
Issue type
Feature
Difficulty
5/5
Estimated time
Over a week
Activity status
Stale
Clarity
Needs clarification
Newbie friendliness
20/100

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