[gmx-users] g_energy statistical information

Juliette N. joojoojooon at gmail.com
Sat May 14 00:47:19 CEST 2011


Hello,

I have a quick question about g_energy output. Can anyone descrive how the
statistical info below are calculated?

In literature I see for instance electrostatics is reported as: XXX + / -
Y. Where Y is deviation or something like that. Which of the RMSD or
Tot-Drift is giving Y ?

g_energy:

Energy                      Average   Err.Est.       RMSD  Tot-Drift


-- 
Thanks,
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