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

@rotate is bool and not str #305

Closed pultar closed 1 year ago

pultar commented 1 year ago

Signed-off-by: Felix Pultar felix.pultar@phys.chem.ethz.ch

Description

Quick fix for gromos++ wrapper sim_box

codecov[bot] commented 1 year ago

Codecov Report

Merging #305 (e58d3b6) into main (ff223be) will not change coverage. The diff coverage is 0.00%.

@@           Coverage Diff           @@
##             main     #305   +/-   ##
=======================================
  Coverage   54.59%   54.59%           
=======================================
  Files          93       93           
  Lines       14372    14372           
=======================================
  Hits         7847     7847           
  Misses       6525     6525           
Flag Coverage Δ
unittests 54.59% <0.00%> (ø)

Flags with carried forward coverage won't be shown. Click here to find out more.

Impacted Files Coverage Δ
pygromos/gromos/gromosPP.py 14.49% <0.00%> (ø)

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