[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 A. Lemkul, Ph.D.
Research Scientist
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


More information about the gromacs.org_gmx-users mailing list