Closed stefdoerr closed 2 years ago
Merging #108 (4107673) into main (bfce3ed) will increase coverage by
0.14%
. The diff coverage is97.82%
.:exclamation: Current head 4107673 differs from pull request most recent head 71e3699. Consider uploading reports for the commit 71e3699 to get more accurate results
@@ Coverage Diff @@
## main #108 +/- ##
==========================================
+ Coverage 76.29% 76.43% +0.14%
==========================================
Files 55 56 +1
Lines 10626 10661 +35
==========================================
+ Hits 8107 8149 +42
+ Misses 2519 2512 -7
Impacted Files | Coverage Δ | |
---|---|---|
moleculekit/vmdparser.py | 75.72% <ø> (-1.15%) |
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moleculekit/bondguesser.py | 97.59% <97.59%> (ø) |
|
moleculekit/interactions/interactions.py | 87.98% <100.00%> (-0.06%) |
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moleculekit/molecule.py | 75.80% <100.00%> (-0.02%) |
:arrow_down: |
moleculekit/projections/metricshell.py | 84.78% <100.00%> (-0.17%) |
:arrow_down: |
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WIP still. Need to add more tests and find the reason for differences (probably the ion radii need overwriting as well)