This is an implementation of the weighted histogram analysis method (WHAM) written in Python. This code allows for the calculation of 1-dimensional and 2-dimensional free energy profiles using data sampled from umbrella simulations. For more information, read the attached PDF summarizing the equations used in WHAM-1D and WHAM-2D.
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jhymel/WHAM
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Implementation of the Weighted Histogram Analysis Method (WHAM) in 1D and 2D written in Python