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Add guide for potential installation #320

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merged 2 commits into from
Aug 17, 2024
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@samwaseda samwaseda commented Aug 7, 2024

Based on this discussion I appended text to the error message. I guess @jan-janssen can update it to make it more accurate.

Summary by CodeRabbit

  • New Features

    • Introduced a detailed installation guide for the potential module to assist users in setup.
  • Bug Fixes

    • Enhanced error messages to include installation instructions when potential files cannot be located.
  • Usability Improvements

    • Provided clear context and guidance directly within error messages to enhance user experience.

@samwaseda samwaseda requested a review from jan-janssen as a code owner August 7, 2024 16:08
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coderabbitai bot commented Aug 7, 2024

Walkthrough

The recent changes to the potential.py file enhance user experience by incorporating a comprehensive installation guide directly within the code. This guide helps users verify their iprpy-data installation and navigate error messages. By appending the installation instructions to relevant error notifications, the updates ensure that users receive immediate context and support when encountering issues, thereby streamlining the troubleshooting process.

Changes

File Change Summary
atomistics/calculators/lammps/potential.py Added an installation guide for the potential module, included in error messages for improved usability.

Poem

🐇 In the realm of code where potentials gleam,
A guide now awaits like a bright, hopeful dream.
When paths go astray, don’t fret, just explore,
With tips in your hands, you’ll find knowledge galore!
So hop through the errors, let worries be few,
For coding is magic, and it starts here with you! 🌟


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Actionable comments posted: 0

Review details

Configuration used: CodeRabbit UI
Review profile: CHILL

Commits

Files that changed from the base of the PR and between 1b6cb68 and 72b037d.

Files selected for processing (1)
  • atomistics/calculators/lammps/potential.py (3 hunks)
Additional comments not posted (3)
atomistics/calculators/lammps/potential.py (3)

8-34: LGTM! The installation guide is clear and well-structured.

The potential_installation guide provides clear and detailed instructions for installing iprpy-data and setting the resource path.


155-157: LGTM! Including the installation guide in the error message is helpful.

The updated error message in _get_potential_df now provides immediate assistance to users encountering issues with locating potential files.


343-343: LGTM! Including the installation guide in the error message is helpful.

The updated error message in get_resource_path_from_conda now provides immediate assistance to users encountering issues with finding the resource path.

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Looks good to me

@jan-janssen jan-janssen linked an issue Aug 17, 2024 that may be closed by this pull request
@jan-janssen jan-janssen merged commit 8c85b30 into main Aug 17, 2024
22 checks passed
@jan-janssen jan-janssen deleted the add_doc_for_potentials branch August 17, 2024 14:43
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Where are the potential files stored?
2 participants