[gmx-users] temperature coupling error message

Luke Czapla czapla at rutchem.rutgers.edu
Tue Oct 30 21:49:08 CET 2001


  I'm trying to use berendsen temperature coupling to maintain the
temperature of the system that I am studying.  I have it applied to
protein and the water solvent (the two groups that exist in the system).
When I run grompp, I get "Fatal error: Not enough ref_t and tau_t values!"
I'm not sure what this means, because there are two sets of these values
defined for protein and sol, and it seems like I have it in the correct
format described in the reference manual.

Luke Czapla

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