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(see the 'labels' on the atom list) Expected behavior
return the same labels.
Additional context
Accurate parsing of the species object is important for restarts and for testing, as they help to avoid obsolete callings of other functions while performing tests, which may cause unrelated failures.
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The text was updated successfully, but these errors were encountered:
Describe the bug
ARCSpecies does not show atom labels for the mol object if it was generated from a
species_dict
How to reproduce
even though the species_dict does have atom labels:
(see the 'labels' on the atom list)
Expected behavior
return the same labels.
Additional context
Accurate parsing of the species object is important for restarts and for testing, as they help to avoid obsolete callings of other functions while performing tests, which may cause unrelated failures.
😄
The text was updated successfully, but these errors were encountered: