[gmx-developers] Fast Multipole

[Timothy DeWolf]

I am not, but I had asked a while back about implementing proper external
(e.g. optical) electromagnetic field support in GORMACS.  Carsten, do you
think that this fast multipole method you're working on would fit this?

-----Original Message-----
From: gromacs.org_gmx-developers-bounces at maillist.sys.kth.se
[mailto:gromacs.org_gmx-developers-bounces at maillist.sys.kth.se] On Behalf
Of Carsten Kutzner
Sent: Monday, February 16, 2015 11:07 AM
To: gmx-developers at gromacs.org
Subject: Re: [gmx-developers] Fast Multipole

Hi,

On 16 Feb 2015, at 20:04, Erik Marklund <erik.marklund at chem.ox.ac.uk>
wrote:

> Dear developers,
>
> Is there anyone actively working on implementing the fast multipole
method?
Yes, we are working on it together with people from research center
Jülich.

Best regards,
  Carsten

>
> Kind regards,
> Erik
>
>
> Erik Marklund, PhD
> Postdoctoral Research Fellow, Fulford JRF
>
> Department of Chemistry
> Physical & Theoretical Chemistry Laboratory University of Oxford South
> Parks Road Oxford
> OX1 3QZ
>
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--
Dr. Carsten Kutzner
Max Planck Institute for Biophysical Chemistry Theoretical and
Computational Biophysics Am Fassberg 11, 37077 Goettingen, Germany Tel.
+49-551-2012313, Fax: +49-551-2012302
http://www.mpibpc.mpg.de/grubmueller/kutzner
http://www.mpibpc.mpg.de/grubmueller/sppexa

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