From owner-chemistry@ccl.net Sat Aug  8 07:51:00 2015
From: "Jerome Kieffer jerome.kieffer/a\terre-adelie.org" <owner-chemistry.:.server.ccl.net>
To: CCL
Subject: CCL: GPU enabled Computational Software
Message-Id: <-51569-150808062401-21265-Mu5sKuZJlgGKCSgVAFyT8g.:.server.ccl.net>
X-Original-From: Jerome Kieffer <jerome.kieffer|,|terre-adelie.org>
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Date: Sat, 8 Aug 2015 12:23:38 +0200
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Sent to CCL by: Jerome Kieffer [jerome.kieffer]_[terre-adelie.org]
On Wed, 29 Jul 2015 23:00:14 +0000 (UTC)
"MARK mark94025|*|comcast.net" <owner-chemistry..ccl.net> wrote:

> See this link on the NVIDIA website for GPU-accelerated applications: http://www.nvidia.com/object/gpu-applications.html 
> 
> Search by molecular dynamics, quantum chemistry, bioinformatics or visualization and docking 

Of course this targets mainly CUDA :)

I know Gromacs and BigDFT have been ported to OpenCL in addition.

Cheers,

Jerome.