[gmx-users] gmx energy: error estimate?

Andreas Mecklenfeld a.mecklenfeld at tu-braunschweig.de
Thu Mar 30 10:45:57 CEST 2017


Dear GROMACS-users,

I've a question regarding the gmx energy command. In the online manual 
it says "An error estimate of the average is given based on a block 
averages over 5 blocks using the full-precision averages.".
How exactly is the error estimate calculated?

Thanks and regards
Andreas

-- 
M. Sc. Andreas Mecklenfeld
Stipendiat

Technische Universität Braunschweig
Institut für Thermodynamik
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38106 Braunschweig
Deutschland / Germany

Tel: +49 (0)531 391-2634
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