diff --git a/bussilab/wham.py b/bussilab/wham.py index a4497a3..5c518bf 100644 --- a/bussilab/wham.py +++ b/bussilab/wham.py @@ -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