deepmodeling / deepmd-kit

A deep learning package for many-body potential energy representation and molecular dynamics
https://docs.deepmodeling.com/projects/deepmd/
GNU Lesser General Public License v3.0
1.41k stars 486 forks source link

v2.2.11 #3940

Closed njzjz closed 1 day ago

njzjz commented 2 days ago

[!WARNING] Do not squash this PR!

codecov[bot] commented 2 days ago

Codecov Report

Attention: Patch coverage is 79.34783% with 19 lines in your changes missing coverage. Please review.

Project coverage is 81.50%. Comparing base (f8a0b31) to head (2b3519a).

Files Patch % Lines
source/lmp/pair_deepmd.cpp 0.00% 8 Missing :warning:
deepmd/descriptor/loc_frame.py 0.00% 2 Missing :warning:
deepmd/model/dos.py 0.00% 1 Missing :warning:
deepmd/model/ener.py 0.00% 1 Missing :warning:
deepmd/model/tensor.py 0.00% 1 Missing :warning:
deepmd/nvnmd/entrypoints/train.py 0.00% 1 Missing :warning:
deepmd/nvnmd/entrypoints/wrap.py 0.00% 1 Missing :warning:
deepmd_utils/entrypoints/doc.py 0.00% 1 Missing :warning:
deepmd_utils/utils/data.py 50.00% 1 Missing :warning:
deepmd_utils/utils/path.py 0.00% 1 Missing :warning:
... and 1 more
Additional details and impacted files ```diff @@ Coverage Diff @@ ## r2 #3940 +/- ## ========================================== - Coverage 81.52% 81.50% -0.02% ========================================== Files 342 342 Lines 33844 33865 +21 Branches 2872 2876 +4 ========================================== + Hits 27590 27601 +11 - Misses 5371 5381 +10 Partials 883 883 ```

:umbrella: View full report in Codecov by Sentry.
:loudspeaker: Have feedback on the report? Share it here.