Re: Question to NAMD source

From: Jim Phillips (jim_at_ks.uiuc.edu)
Date: Thu Sep 04 2014 - 11:25:48 CDT

You don't. The coordinates of all atoms are generally not available to a
single node. What are you trying to do? There may be a better way.

Jim

On Thu, 4 Sep 2014, Norman Geist wrote:

> Hey experts,
>
>
>
> how would I access ALL atoms coordinates not only current patch from within
> f.i. ComputeSphericalBC::do_force ??
>
>
>
> Thanks
>
>
>
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