[gmx-users] gmx 3.2.2
Erik Lindahl
lindahl at sbc.su.se
Tue Aug 31 10:10:37 CEST 2004
Hi Nuno,
In principle we don't include new _supported_ features in the point
releases, although there are sometimes new force fields for testing
(OPLS was for instance introduced first in 3.1.4, and fully supported
from 3.2).
We're having some problems with the RPMs since the old supporting
packages (LAM, FFTW) no longer work on the newest Fedora and RedHat
releases, so I'm looking into upgrade those before making the formal
announcement.
(As for forcefields, we've "experimentally" included Gromos96 45a3 and
Encad in 3.2.2, although they are pretty straightforward so I don't
expect any significant issues).
Cheers,
Erik
On Aug 30, 2004, at 1:02 PM, Nuno R. L. Ferreira wrote:
> Hi *
>
> Is there a list of what's new/corrected is this new minor version?
>
> Best regards,
> Nuno
>
>
> ######################################
> Nuno Ricardo Santos Loureiro da Silva Ferreira
> Departamento de Química
> Faculdade de Ciências e Tecnologia
> Universidade de Coimbra
> 3004-535 Coimbra - Portugal
> Fax: +351 239 827703 - www.biolchem.qui.uc.pt
> ########################################
>
>
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