fes from metadynamics
sam moors
samm... at gmail.com
Fri Jun 8 13:05:33 UTC 2012
Hi,
I would like to generate a 1D fes from a 2D metadynamics simulation (2
collective variables).
However, with the fes.sopt program, I get different results depending on
the value of the -ndim option (1 or 2).
What is the difference between the free energy profiles generated with
these two values, and which is the correct one?
Thanks in advance,
Sam
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