[gmx-users] initial velocities analysis
ddubov at ngs.ru
Thu Aug 26 09:52:13 CEST 2010
I'm also interested in this question. Could you make clear:
> Anna Marabotti wrote:
>> - is there a way to check for the velocities or for the random seed
>> used? I had a look at the .log file but I didn't find the information.
>> g_traj generated a very big file, and presently I have some problems to
>> analyze it. How can I see initial velocities?
In other words, when gen_seed is set to -1, there is a rigorous rule for seed calculation. How can I get the value of this seed? I need it to repeat exactly the same run, e.g., with more detailed outputs.
Dmitri mailto:ddubov at ngs.ru
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