jensengroup / propka

PROPKA predicts the pKa values of ionizable groups in proteins and protein-ligand complexes based in the 3D structure.
http://propka.org
GNU Lesser General Public License v2.1
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Add test for issue #140 #170

Closed speleo3 closed 1 year ago

speleo3 commented 1 year ago

Add test for issue #140 which was fixed in #169

codecov[bot] commented 1 year ago

Codecov Report

All modified and coverable lines are covered by tests :white_check_mark:

Comparison is base (33158d1) 73.05% compared to head (b9a263f) 73.10%.

:exclamation: Current head b9a263f differs from pull request most recent head 54d76ec. Consider uploading reports for the commit 54d76ec to get more accurate results

Additional details and impacted files ```diff @@ Coverage Diff @@ ## master #170 +/- ## ========================================== + Coverage 73.05% 73.10% +0.05% ========================================== Files 25 25 Lines 3989 3989 ========================================== + Hits 2914 2916 +2 + Misses 1075 1073 -2 ``` [see 1 file with indirect coverage changes](https://app.codecov.io/gh/jensengroup/propka/pull/170/indirect-changes?src=pr&el=tree-more&utm_medium=referral&utm_source=github&utm_content=comment&utm_campaign=pr+comments&utm_term=jensengroup)

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