[gmx-users] AWH with two bias potentials

Berk Hess gmx3 at hotmail.com
Thu Feb 14 15:27:16 CET 2019


gmx awh writes out the 2D (or any-D) PMF to xvg files for different times. The 1D nature of xvg files is not convenient for visualization though, so you need to write a script to convert it to you favorite 2D data format. I probably have a script somewhere for some 2D format (python?) if you can't write it yourself.

Berk



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