gmx::anonymous_namespace{histogramsize.cpp} Namespace Reference

Functions
bool	histogramIsEquilibrated (const std::vector< PointState > &pointStates)
	Checks if the histogram has equilibrated to the target distribution. More...

Function Documentation

bool gmx::anonymous_namespace{histogramsize.cpp}::histogramIsEquilibrated

(

const std::vector< PointState > &

pointStates

)

Checks if the histogram has equilibrated to the target distribution.

The histogram is considered equilibrated if, for a minimum fraction of the target region, the relative error of the sampled weight relative to the target is less than a tolerance value.

Parameters

[in]

pointStates

The state of the bias points.

Returns

true if the histogram is equilibrated.