[gmx-users] density graph

Justin A. Lemkul jalemkul at vt.edu
Wed Oct 15 03:07:03 CEST 2008

hhhh huan wrote:
> Dear all gmx users and developers, 
>  Is it correct that in gromacs energy (density graph), the y-axis is labelled    as kJ/mol, I am wonder it is not a density unit.

In the output that I have from g_density (v 3.3), the the .xvg file has the 
y-axis labeled as:

yaxis  label "Density (kg/m\S3\N)"

...which is a density unit.  Where are you seeing kJ/mol?  Which version of 
Gromacs?  What command did you issue?


> Thanks
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Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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