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rinikerlab / PyGromosTools

This package is a python library with tools for the Molecular Simulation - Software Gromos. It allows you to easily set up, manage and analyze simulations in python.
https://rinikerlab.github.io/PyGromosTools/
MIT License
16 stars 14 forks source link

Test warnings #217

Closed MTLehner closed 2 years ago

MTLehner commented 2 years ago

This PR should fix issue #217

codecov[bot] commented 2 years ago

Codecov Report

Merging #217 (79a5ee1) into release3 (d7fa71a) will decrease coverage by 0.17%. The diff coverage is n/a.

Impacted file tree graph

@@             Coverage Diff              @@
##           release3     #217      +/-   ##
============================================
- Coverage     52.71%   52.54%   -0.18%     
============================================
  Files            93       93              
  Lines         12885    12885              
============================================
- Hits           6792     6770      -22     
- Misses         6093     6115      +22
Flag Coverage Δ
unittests 52.54% <ø> (-0.18%) :arrow_down:

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Impacted Files Coverage Δ
...s/simulations/modules/preset_simulation_modules.py 58.82% <ø> (ø)
pygromos/simulations/modules/ti_modules.py 92.50% <ø> (ø)
.../job_scheduling/schedulers/simulation_scheduler.py 63.44% <0.00%> (-9.68%) :arrow_down:
...imulations/hpc_queuing/submission_systems/dummy.py 82.35% <0.00%> (-5.89%) :arrow_down:
...imulations/hpc_queuing/submission_systems/local.py 53.75% <0.00%> (-5.00%) :arrow_down:
.../simulations/modules/general_simulation_modules.py 68.96% <0.00%> (-3.45%) :arrow_down:
.../simulations/hpc_queuing/submission_systems/lsf.py 43.63% <0.00%> (-1.37%) :arrow_down:

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