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Change descriptor output to 3D format as requested

0469a5b
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feat: Add eval-desc CLI command for descriptor evaluation with 3D output format #4903

Change descriptor output to 3D format as requested
0469a5b
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Codecov / codecov/project succeeded Aug 23, 2025 in 0s

84.29% (+0.00%) compared to 6dac4f9

View this Pull Request on Codecov

84.29% (+0.00%) compared to 6dac4f9

Details

Codecov Report

❌ Patch coverage is 82.81250% with 11 lines in your changes missing coverage. Please review.
✅ Project coverage is 84.29%. Comparing base (6dac4f9) to head (0469a5b).

Files with missing lines Patch % Lines
deepmd/entrypoints/eval_desc.py 83.01% 9 Missing ⚠️
deepmd/entrypoints/main.py 50.00% 2 Missing ⚠️
Additional details and impacted files
@@           Coverage Diff           @@
##            devel    #4903   +/-   ##
=======================================
  Coverage   84.29%   84.29%           
=======================================
  Files         702      703    +1     
  Lines       68665    68726   +61     
  Branches     3573     3573           
=======================================
+ Hits        57882    57935   +53     
- Misses       9643     9651    +8     
  Partials     1140     1140           

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