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Fix pdm github actions #306

Merged
merged 3 commits into from
Jan 27, 2025
Merged

Fix pdm github actions #306

merged 3 commits into from
Jan 27, 2025

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mogres
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@mogres mogres commented Jan 22, 2025

Problem

Some github actions are failing due to outdated version of actions

Solution

Updated actions to run commands within virtual environment

Type of change

  • Bug fix (non-breaking change which fixes an issue)

Steps to Verify:

  1. Merge PR within main branch
  2. Tests and documentation should run as expected

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github-actions bot commented Jan 22, 2025

Packing analysis report

Analysis for packing results located at cellpack/tests/outputs/test_spheres/spheresSST

Ingredient name Encapsulating radius Average number packed
ext_A 25 236.0

Packing image

Packing image

Distance analysis

Expected minimum distance: 50.00
Actual minimum distance: 50.01

Ingredient key Pairwise distance distribution
ext_A Distance distribution ext_A

@mogres mogres requested review from meganrm and rugeli January 22, 2025 01:22
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@rugeli rugeli left a comment

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Seems working well, nice job!

@mogres mogres merged commit 4251109 into main Jan 27, 2025
7 checks passed
@mogres mogres deleted the fix/pdm-github-actions branch January 27, 2025 17:50
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2 participants