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Commit 5b0ba4f0 authored by Carlo Camilloni's avatar Carlo Camilloni Committed by Giovanni Bussi
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belfast8: more

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......@@ -270,6 +270,14 @@ gnuplot> plot [0:40]'FES' u 2:3
\endverbatim
plots the microstate error in the free energy estimate as a function of the microstates free energy.
Finally in the folder metagui/FES there is script to integrate the multidimensional free energy contained in the MICROSTATES files
to a 2D FES as a function of two of the used CV. To use it is enough to copy the MICROSTATES file in FES:
\verbatim
cp MICROSTATES FES/FES.4D
\endverbatim
and edit the script to select the two columns of MICROSTATES on which show the integrated FES.
\Reference
......
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