[gmx-users] gromacs 3.2.0 beta
David van der Spoel
spoel at xray.bmc.uu.se
Mon Dec 8 11:43:00 CET 2003
On Mon, 2003-12-08 at 11:35, Mu Yuguang (Dr) wrote:
> Could you tell us what are the major improvement of this 3.2.0 than
> 3.1.4 ?
>
bug fixes in many programs, including mdrun crashes on parallel machines
due to no water on processor 0.
usability enhances in analysis tools and also in pdb2gmx.
A (rather) complete list of differences will be made before the final
release.
> Regards
> Yuguang
>
> Dr. Yuguang Mu
> Division of Computational and Structrual Biology
> School of Biological Sciences
> Nanyang Technological University
> Singapore 637820
> Tel: 0065-67906489
>
>
> -----Original Message-----
> From: David [mailto:spoel at xray.bmc.uu.se]
> Sent: Monday, December 08, 2003 3:41 PM
> To: gmx-users at gromacs.org
> Subject: [gmx-users] gromacs 3.2.0 beta
>
> Dear all,
>
> we have put up a beta version of the upcoming gromacs 3.2.0 release for
> download from
> ftp://ftp.gromacs.org/pub/beta
> or from
> http://www.gromacs.org/download/webftp.php
>
> please test it and report problems back to the list.
--
David.
________________________________________________________________________
David van der Spoel, PhD, Assist. 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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