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GiovanniBussi committed Sep 25, 2023
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2 changes: 1 addition & 1 deletion bussilab/wham.py
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Expand Up @@ -61,7 +61,7 @@ def wham(bias,
Bugs
----
Currently, method="minimize" does not work correctly when setting traj_weights.
Up to version 0.042, method="minimize" does not work correctly when setting traj_weights.
As a consequence, results produced with v0.0.41, where this method is the default,
might be incorrect. In v0.0.42 this is temporarily fixed by reverting to method="substitute"
when using traj_weights. In v0.0.43 this should be finally fixed: both methods should
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