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mosdef-hub
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foyer
A package for atom-typing as well as applying and disseminating forcefields
https://foyer.mosdef.org
MIT License
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Report missing bonds' types when using verbose flag
#486
Closed
jennyfothergill
closed
2 years ago
jennyfothergill
commented
2 years ago
PR Summary:
Fixes #485 Adds printout of missing bond types.
PR Checklist
[ ] Includes appropriate unit test(s)
[ ] Appropriate docstring(s) are added/updated
[x] Code is (approximately) PEP8 compliant
[x] Issue(s) raised/addressed?
daico007
commented
2 years ago
/azp run
azure-pipelines[bot]
commented
2 years ago
Azure Pipelines successfully started running 1 pipeline(s).
PR Summary:
Fixes #485 Adds printout of missing bond types.
PR Checklist