[gmx-users] gen_vel
David
spoel at xray.bmc.uu.se
Mon Feb 24 18:39:31 CET 2003
On Mon, 2003-02-24 at 19:29, Luciane Vieira de Mello wrote:
>
> Dear all,
>
> I am interested in generate velocities according to a Maxwell distribution
> at temperature gen_temp [K], with random seed gen_seed.
>
> I can see the default random number is: (173529)
>
> Is it right all I need to change is the gen-seed number at .mdp file?
> ; GENERATE VELOCITIES FOR STARTUP RUN =
> gen-vel = yes
> gen-temp = 300
> gen-seed = 1
With different seed you get a different velocity distribution.
Was that the question?
>
> Thanks in advance.
> Luciane
>
>
>
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--
Groeten, David.
________________________________________________________________________
Dr. David van der Spoel, Dept. of Cell and Molecular Biology
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://xray.bmc.uu.se/~spoel
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