[gmx-users] Standard errors

Mark Abraham mark.j.abraham at gmail.com
Tue Sep 17 08:29:01 CEST 2013


Standard error and standard deviation measure different things. Please
consult a general work on reporting scientific results.

Mark

On Mon, Sep 16, 2013 at 7:40 AM, afsaneh maleki
<maleki.afsaneh at gmail.com> wrote:
> Dear all
>
>
>
> I would like to calculate the standard deviation (as the error bar) for
> dV/dlanda.xvg file. I used g_analyze command as the following:
>
>
>
> g_analyze   -f    free_bi_0.9.xvg  -av  average_0.9
>
> I got:
>
> set       average              *standard  deviation*       *std. dev.  /
> sqrt(n-1)    *…
>
> SS1    6.053822e+01     3.062230e+01              1.936724e-02        …
>
> Is the amount of in third (standard deviation) or fourth column (std. dev.  /
> sqrt(n-1) ) better than to use as the standard errors?
>
> I want to draw dG/d lambda via lambda and show error bar for free energy.
>
>
>
> Thanks in advance
>
> Afsaneh
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