[ANN] Molecula Numerica Released (beta)

Andreas Micheler Andreas.Micheler at Student.Uni-Augsburg.de
Mon Mar 31 16:55:03 PDT 2008



ABE Hiroshi wrote:
> http://arlivre.ddo.jp/Physica/

I'm very interested in Molecular Dynamics, too!

Could you try to make a Windows binary?

As you can see here:
<http://www.aucblogo.org/aUCBLogo_Screenshot3.png>,
I have written a few Logo programs
to simulate the rotational equation of one molecule,
and also some experiments to simulate more than one,
but they are pretty slow. :-(

Do you compute all N^2/2 forces, if you have N Atoms?
Or do you have some grid array, so only the nearer atoms are considered?
I'm curious how fast it is!

Greetings,
Andreas


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