[gmx-users] g_gyrate
Xu Dong Huang
xudongh at eden.rutgers.edu
Sun Jan 6 03:21:31 CET 2013
@ Justin,
Thank you.
Xu Dong Huang
Chemical & Biochemical Engineering
Rutgers School of Engineering
xudongh at eden.rutgers.edu
On Jan 5, 2013, at 9:15 PM, Justin Lemkul <jalemkul at vt.edu> wrote:
>
>
> On 1/5/13 9:08 PM, Xu Dong Huang wrote:
>> Dear gromac users,
>>
>> If I wish to measure the distance from 1 end of my polymer to the other end, would it be valid to use g_gyrate? Even so, does that report just the radius, hence the function name radius of gyration?
>>
>
> g_polystat may be even more useful.
>
> -Justin
>
> --
> ========================================
>
> 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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