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Codecov Report

Attention: Patch coverage is 75.22321% with 111 lines in your changes missing coverage. Please review.

Project coverage is 71.58%. Comparing base (f3a3779) to head (c17395c).
Report is 13 commits behind head on main.

Files with missing lines	Patch %	Lines
alignn/train.py	71.42%	24 Missing ⚠️
alignn/models/utils.py	37.50%	20 Missing ⚠️
alignn/models/alignn_atomwise.py	77.46%	16 Missing ⚠️
alignn/utils.py	65.00%	14 Missing ⚠️
alignn/lmdb_dataset.py	56.52%	10 Missing ⚠️
alignn/ff/ff.py	81.63%	9 Missing ⚠️
alignn/graphs.py	90.66%	7 Missing ⚠️
alignn/train_alignn.py	69.56%	7 Missing ⚠️
alignn/tests/test_alignn_ff.py	87.50%	3 Missing ⚠️
alignn/data.py	0.00%	1 Missing ⚠️

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Additional details and impacted files

@@            Coverage Diff             @@
##             main     #172      +/-   ##
==========================================
- Coverage   73.45%   71.58%   -1.87%     
==========================================
  Files          17       17              
  Lines        2844     3009     +165     
==========================================
+ Hits         2089     2154      +65     
- Misses        755      855     +100     

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