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support atomic/relative model deviation in CLI#2801

Merged
wanghan-iapcm merged 5 commits intodeepmodeling:develfrom
njzjz:atomic-relative-md
Sep 12, 2023
Merged

support atomic/relative model deviation in CLI#2801
wanghan-iapcm merged 5 commits intodeepmodeling:develfrom
njzjz:atomic-relative-md

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@njzjz njzjz commented Sep 9, 2023

Fix #2017.

Fix deepmodeling#2017.

Signed-off-by: Jinzhe Zeng <jinzhe.zeng@rutgers.edu>
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codecov bot commented Sep 9, 2023

Codecov Report

Patch coverage: 90.47% and project coverage change: +2.23% 🎉

Comparison is base (c6829bc) 79.38% compared to head (6ac8f44) 81.62%.
Report is 1 commits behind head on devel.

Additional details and impacted files
@@            Coverage Diff             @@
##            devel    #2801      +/-   ##
==========================================
+ Coverage   79.38%   81.62%   +2.23%     
==========================================
  Files         244      212      -32     
  Lines       25868    21090    -4778     
  Branches     1528        0    -1528     
==========================================
- Hits        20535    17214    -3321     
+ Misses       4936     3876    -1060     
+ Partials      397        0     -397     
Files Changed Coverage Δ
deepmd/infer/model_devi.py 94.19% <89.74%> (-1.81%) ⬇️
deepmd_cli/main.py 100.00% <100.00%> (ø)

... and 110 files with indirect coverage changes

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@njzjz njzjz requested a review from wanghan-iapcm September 11, 2023 19:23
@wanghan-iapcm wanghan-iapcm merged commit b6ff8aa into deepmodeling:devel Sep 12, 2023
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[Feature Request] support relative and atomic model deviation for CLI

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