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fix(pt_expt): fail-fast on .pt2 GNN inference without LAMMPS atom-map #5450

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fix(pt_expt): fail-fast on .pt2 GNN inference without LAMMPS atom-map

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fix(pt_expt): fail-fast on .pt2 GNN inference without LAMMPS atom-map #5450

fix(pt_expt): fail-fast on .pt2 GNN inference without LAMMPS atom-map
9175247
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Codecov / codecov/project succeeded May 21, 2026 in 0s

80.75% (-1.73%) compared to d3f08f3

View this Pull Request on Codecov

80.75% (-1.73%) compared to d3f08f3

Details

Codecov Report

❌ Patch coverage is 52.17391% with 11 lines in your changes missing coverage. Please review.
✅ Project coverage is 80.75%. Comparing base (d3f08f3) to head (9175247).

Files with missing lines Patch % Lines
source/api_cc/src/DeepPotPTExpt.cc 55.55% 3 Missing and 1 partial ⚠️
source/api_cc/src/DeepSpinPTExpt.cc 42.85% 4 Missing ⚠️
deepmd/pt_expt/utils/serialization.py 57.14% 3 Missing ⚠️
Additional details and impacted files 
@@            Coverage Diff             @@
##           master    #5450      +/-   ##
==========================================
- Coverage   82.48%   80.75%   -1.73%     
==========================================
  Files         830      830              
  Lines       88522    88527       +5     
  Branches     4232     4231       -1     
==========================================
- Hits        73015    71489    -1526     
- Misses      14220    15913    +1693     
+ Partials     1287     1125     -162

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