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Feature/validate with input smiles#3

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eliaslmann merged 1 commit intomasterfrom
feature/validate-with-input-smiles
Mar 23, 2026
Merged

Feature/validate with input smiles#3
eliaslmann merged 1 commit intomasterfrom
feature/validate-with-input-smiles

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@eliaslmann eliaslmann requested a review from corinwagen March 23, 2026 20:42
@eliaslmann eliaslmann closed this Mar 23, 2026
@eliaslmann eliaslmann reopened this Mar 23, 2026
@eliaslmann eliaslmann force-pushed the feature/validate-with-input-smiles branch from 3a5e097 to c5ef4c0 Compare March 23, 2026 20:50
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looks good!

Comment thread steamroll/steamroll.py Outdated
@eliaslmann eliaslmann force-pushed the feature/validate-with-input-smiles branch from 31f5c3d to 57b129e Compare March 23, 2026 21:27
@eliaslmann eliaslmann force-pushed the feature/validate-with-input-smiles branch from 57b129e to 3aae458 Compare March 23, 2026 21:30
@eliaslmann eliaslmann merged commit bddf03d into rowansci:master Mar 23, 2026
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@eliaslmann eliaslmann deleted the feature/validate-with-input-smiles branch March 23, 2026 21:32
jevandezande pushed a commit that referenced this pull request Apr 2, 2026
Uses a template to correctly re-order atoms
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2 participants