[gmx-users] how to indicate solvent flexibility?

Justin Lemkul jalemkul at vt.edu
Thu Jan 10 12:27:56 CET 2013



On 1/10/13 5:21 AM, Albert wrote:
> On 01/10/2013 11:14 AM, David van der Spoel wrote:
>> On 2013-01-10 10:45, Albert wrote:
>>> Hello Justin and Leandro:
>>>
>>>    thanks a lot for kind advices. I am trying to us the g_msd to
>>> calculate the density:
>>
>> try g_msd -h
>> wrong tool.
>
> that's strange. Here is the information which I think it is what I want.
>

David's point was that g_msd does not calculate density, which you stated was 
what you were trying to do.

-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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