[gmx-developers] Re: gmx-developers Digest, Vol 16, Issue 16
spoel at xray.bmc.uu.se
Thu Aug 11 19:37:16 CEST 2005
On Thu, 2005-08-11 at 13:23 -0400, Michael Shirts wrote:
> Hi, all-
> Obviously this is getting to be quite confusing. I'll volunteer to
> head up a "examine thermostat and barostat" squad to try to get best
> practices in the next version of gromacs -- I've worked with the
> current version fairly extensively trying new things out (though there
> is obviously much more I need to try!). I'll be pretty busy up
> through the end of ACS Sept 1, but should have some decent time after
OK, you're hired.
We'll have to get 3.3 out the door soon so that we can start with all
the fun stuff...
David van der Spoel, PhD, Assoc. Prof., Molecular Biophysics group,
Dept. of Cell and Molecular Biology, Uppsala University.
Husargatan 3, Box 596, 75124 Uppsala, Sweden
phone: 46 18 471 4205 fax: 46 18 511 755
spoel at xray.bmc.uu.se spoel at gromacs.org http://xray.bmc.uu.se/~spoel
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