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Bond/Angle/Dihedral transforms #860

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jennyfothergill
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PR Summary:

Fixes #356

I thought it might be nice to have some convenience functions for adjusting bonds, angles, and dihedrals. These functions are only in the included notebook right now--I'd like feedback on where they should go. 😅

PR Checklist


  • Includes appropriate unit test(s)
  • Appropriate docstring(s) are added/updated
  • Code is (approximately) PEP8 compliant
  • Issue(s) raised/addressed?

@jennyfothergill jennyfothergill added the WIP Work in Progress, not ready for merging label Apr 12, 2021
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codecov bot commented Apr 12, 2021

Codecov Report

Merging #860 (0d43cfb) into master (a185759) will decrease coverage by 0.00%.
The diff coverage is 66.66%.

Impacted file tree graph

@@            Coverage Diff             @@
##           master     #860      +/-   ##
==========================================
- Coverage   88.47%   88.46%   -0.01%     
==========================================
  Files          62       62              
  Lines        7841     7843       +2     
==========================================
+ Hits         6937     6938       +1     
- Misses        904      905       +1     
Impacted Files Coverage Δ
mbuild/compound.py 97.43% <66.66%> (-0.14%) ⬇️

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