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fix(fmt/smi): use correct bond order sum for smiles string #299

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merged 3 commits into from
Apr 12, 2024

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@jnooree jnooree commented Apr 12, 2024

Checklist

If the change is related to the source code, tests, or build environments, please also check the following:

  • Does ./scripts/run_clang_tools.sh pass without any warnings?
  • Have you built the project locally without any warnings and errors?
  • Does all tests (if new tests are added, including the new ones) pass?

If you added new feature(s), then also check the following:

  • Did you also add corresponding tests?

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@jnooree jnooree enabled auto-merge April 12, 2024 06:24
@jnooree jnooree disabled auto-merge April 12, 2024 06:28
@jnooree jnooree merged commit 4452ced into main Apr 12, 2024
14 of 15 checks passed
@jnooree jnooree deleted the jnooree/issue-298 branch April 12, 2024 06:29
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[BUG] smiles does not set correct implicit hydrogen count
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