Uses of Class
ffx.numerics.estimator.Zwanzig
Packages that use Zwanzig
Package
Description
The Estimator package implements free energy estimators (e.g., Zwanzig, BAR/MBAR)
and related bootstrapping and reporting utilities.
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Uses of Zwanzig in ffx.numerics.estimator
Methods in ffx.numerics.estimator that return ZwanzigModifier and TypeMethodDescriptionZwanzig.copyEstimator()Return a copy of this Estimator.BennettAcceptanceRatio.getInitialBackwardsGuess()Returns the backwards Zwanzig estimator used to seed BAR.BennettAcceptanceRatio.getInitialForwardsGuess()Returns the forwards Zwanzig estimator used to seed BAR.