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Add hydrogens to caps #320

Merged
merged 1 commit into from
Dec 3, 2024
Merged

Add hydrogens to caps #320

merged 1 commit into from
Dec 3, 2024

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peastman
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@peastman peastman commented Dec 3, 2024

Fixes #319. This is a bug introduced by #296 that prevented it from adding hydrogens to ACE and NME caps.

@peastman peastman merged commit b31b57b into openmm:master Dec 3, 2024
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@peastman peastman deleted the caps branch December 3, 2024 23:04
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Successfully merging this pull request may close these issues.

ACE ignored when calling addMissingHydrogens
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