[gmx-developers] GPU Code?

Ansgar Esztermann aeszter at gwdg.de
Tue Apr 3 18:59:20 CEST 2007

Hello Erik,

> The GPU code isn't available for the time being; we're keeping it  
> internal to a collaboration with Vijay's group until we've managed to  
> make it slightly more generally usable so we at least can publish the  
> algorithms/implementation before giving it away to the world :-) The  
> problem isn't "implicit solvent", but even getting neighborlists to  
> work, and that it partly relies on non-disclosure stuff from ATI that  
> we aren't allowed to redistribute.

Any chance to get into the team? Gromacs is an enormously important
tool for our group, and we're interested in contributing to the


Ansgar Esztermann
Researcher & Sysadmin
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