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Change default max3d value to 1.0 #94

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Merged
IAlibay merged 1 commit into from
Nov 20, 2025
Merged

Change default max3d value to 1.0 #94

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2 changes: 1 addition & 1 deletion src/lomap/gufe_bindings/mapper.py
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Original file line number Diff line number Diff line change
Expand Up @@ -36,7 +36,7 @@ def __init__(self, *, time: int = 20, threed: bool = True,
equivalent mappings and prune the mapping, default True
max3d : float, optional
maximum discrepancy in Angstroms between atoms before mapping is not
allowed, default 1000.0, which effectively trims no atoms
allowed, default 1.0
element_change: bool, optional
whether to allow element changes in the mappings, default True
seed: str, optional
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