[gmx-users] Temperature Histogram

[Justin Lemkul]

On 11/7/12 11:42 AM, Samadashvili Nino wrote:
> Hello,
>
>    I would like to calculate temperature in my system along the axis. Could you please tell me if there is a way to make a temperature histogram with Gromacs?
>

Use g_energy to extract temperatures from the .edr file, then g_analyze -dist on 
that .xvg file.

-Justin

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Justin A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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