The group PROTEIN isn't very large as the group NONPROTEIN, therefore its total kinetic energy fluctuates more. --Omer.
On Wed, Sep 16, 2009 at 12:10, Stephane Abel <stephane.a...@cea.fr> wrote: > tc-grps = Protein Non-Protein ; two coupling groups - more accurate > tau_t = 0.4 0.4 ; time constant, in ps > ref_t = 310 310 ; reference temperature, one for each group, in K Energy Average RMSD Fluct. Drift Tot-Drift > > ------------------------------------------------------------------------------- > Temperature 310 2.46886 2.46886 6.12135e-07 0.0171398 > T-Protein 310 32.1134 32.1117 -4.10352e-05 -1.14898 > T-Non-Protein 310 2.47549 2.47548 8.55869e-07 0.0239643 >
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