logsdail / carmm

Scripts for creation, manipulation and analysis of geometric and electronic structure of molecular models
GNU General Public License v3.0
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[WIP] reintroduced task farmed NEBs to workflows #139

Open ikowalec opened 7 months ago

ikowalec commented 7 months ago

As per title.

Must introduce:

codecov[bot] commented 7 months ago

Codecov Report

Attention: 21 lines in your changes are missing coverage. Please review.

Comparison is base (68fddf9) 86.58% compared to head (49cdccb) 86.28%.

Files Patch % Lines
carmm/run/workflows/react.py 67.50% 13 Missing :warning:
carmm/run/workflows/helper.py 11.11% 8 Missing :warning:
Additional details and impacted files ```diff @@ Coverage Diff @@ ## master #139 +/- ## ========================================== - Coverage 86.58% 86.28% -0.31% ========================================== Files 72 73 +1 Lines 2847 2945 +98 ========================================== + Hits 2465 2541 +76 - Misses 382 404 +22 ``` | [Flag](https://app.codecov.io/gh/logsdail/carmm/pull/139/flags?src=pr&el=flags&utm_medium=referral&utm_source=github&utm_content=comment&utm_campaign=pr+comments&utm_term=Andrew+Logsdail) | Coverage Δ | | |---|---|---| | [unittests](https://app.codecov.io/gh/logsdail/carmm/pull/139/flags?src=pr&el=flag&utm_medium=referral&utm_source=github&utm_content=comment&utm_campaign=pr+comments&utm_term=Andrew+Logsdail) | `86.28% <73.75%> (-0.31%)` | :arrow_down: | Flags with carried forward coverage won't be shown. [Click here](https://docs.codecov.io/docs/carryforward-flags?utm_medium=referral&utm_source=github&utm_content=comment&utm_campaign=pr+comments&utm_term=Andrew+Logsdail#carryforward-flags-in-the-pull-request-comment) to find out more.

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