ReactionMechanismGenerator / ReactionMechanismGenerator/ARC

improved trsh

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#933 1 comment 0 reactions 0 assignees View on GitHub

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Type: Feature
Dominant language
Python
Stars
51
Forks
25
Avg merge
4d 5h
Merged PRs (30d)
15

Description

ARC's trsh is messy.
we should create a Trsh() class per instance, and keeping it with the SPecies/Reaction object, adding attributes as needed, so it also provides memory between runs and can become more sophisticated in its trsh recommendations when necessary

Contributor guide

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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 locating ARC's current trsh implementation and the Species and Reaction classes mentioned in the issue. Trace how trsh state is created and used across runs, then define what it means for each Species or Reaction to retain a Trsh instance and memory; completion should include the class integration and behavior needed for future recommendations.

Written by the indexing model from the issue text.

Assessment

Tech stack
python
Domain
backend, tooling
Issue type
Refactor
Difficulty
5/5
Estimated time
Over a week
Activity status
Quiet
Clarity
Needs clarification
Newbie friendliness
35/100

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