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fix: permute U in association_schemes_stripped

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Raktim Mitra
2026-02-19 00:05:08 -08:00
committed by Raktim Mitra
parent 3d016cd389
commit 84648be95a
1 changed files with 1 additions and 4 deletions
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5
models/rfd3/src/rfd3/constants.py
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@@ -226,10 +226,7 @@ ATOM14_ATOM_NAME_TO_ELEMENT = {
strip_list = lambda x: [(x.strip() if x is not None else None) for x in x] # noqa
association_schemes_stripped = {
name: {k: strip_list(v) for k, v in scheme.items()}
for name, scheme in association_schemes.items()
}
SELECTION_PROTEIN = ["POLYPEPTIDE(D)", "POLYPEPTIDE(L)"]
SELECTION_NONPROTEIN = [
"POLYDEOXYRIBONUCLEOTIDE",