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Fix rotamer shuffle when repairing PDB structures pre-repack. - #206

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mtessmer merged 2 commits into
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fix/mutate-fill-missing-atoms
Jun 4, 2026
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Fix rotamer shuffle when repairing PDB structures pre-repack. #206
mtessmer merged 2 commits into
mainfrom
fix/mutate-fill-missing-atoms

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…hen missing atoms. Fix loss of protonation state when mutating. Add tests and test data.
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mtessmer merged commit 15eb3b1 into mainJun 4, 2026
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mtessmer deleted the fix/mutate-fill-missing-atoms branch June 4, 2026 16:53
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