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Fix test_depiction now that toolkit doesn't handle radicals #151

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merged 5 commits into from Sep 30, 2022

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j-wags
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@j-wags j-wags commented Sep 26, 2022

Description

The tests in test_depiction used mapped SMILES to define test molecules. However, molecules created using mapped SMILES are expected to have explicit Hs, which these test SMILES didn't. This PR makes the Hs explicit on these input SMILES.

Todos

  • Fix tests
  • black

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  • Ready to go

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codecov bot commented Sep 26, 2022

Codecov Report

❗ No coverage uploaded for pull request base (main@0ac87f1). Click here to learn what that means.
The diff coverage is n/a.

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@j-wags
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j-wags commented Sep 30, 2022

Merging. This only affects CI, so it's not worth making a new release.

@j-wags j-wags merged commit 1b3414b into main Sep 30, 2022
@j-wags j-wags deleted the fix-depict-tests branch September 30, 2022 15:46
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