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Updated to standard structure handling #121

Merged
merged 2 commits into from
Oct 30, 2023
Merged

Updated to standard structure handling #121

merged 2 commits into from
Oct 30, 2023

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paulsaxe
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  • Adds IUPAC names, InChI and InChIKey as possible names for configurations
  • Cleaned up output to be properly indented and laid out.

@paulsaxe paulsaxe added the enhancement New feature or request label Oct 30, 2023
@paulsaxe paulsaxe requested a review from seamm October 30, 2023 15:50
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@seamm seamm left a comment

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LGTM

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codecov bot commented Oct 30, 2023

Codecov Report

Merging #121 (59aedbb) into main (b24d9cd) will decrease coverage by 0.12%.
The diff coverage is 0.00%.

Additional details and impacted files

@seamm seamm merged commit d6a3e0f into main Oct 30, 2023
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2 participants