[gmx-developers] next Gromacs release

Shirts, Michael (mrs5pt) mrs5pt at eservices.virginia.edu
Thu Jun 17 16:03:25 CEST 2010


I've got some more manual changes/corrections that I need to get in -- I'll
have time by Saturday/Sunday morning to add then.

Best,
~~~~~~~~~~~~
Michael Shirts
Assistant Professor
Department of Chemical Engineering
University of Virginia
michael.shirts at virginia.edu
(434)-243-1821


> From: Rossen Apostolov <rossen.apostolov at cbr.su.se>
> Reply-To: Discussion list for GROMACS development <gmx-developers at gromacs.org>
> Date: Thu, 17 Jun 2010 09:57:31 -0400
> To: "gmx-developers at gromacs.org" <gmx-developers at gromacs.org>
> Subject: Re: [gmx-developers] next Gromacs release
> 
> Hi,
> 
> It seems that June 15 was a little too ambitious for a release date but at
> least things are wrapping up. Here is what is still on the table
> (functionality wise):
> 
>  *   amber ff - Berk will have this in very soon
>  *   history function - Roland can merge the branch into master
>  *   it will be nice to include also g_membed (from Gerrit Groenhof) and
> g_correlation (from Helmut Grubmuller)
> 
> We  don't need to close everything in bugzilla before the release, but we need
> a list of the "blockers" which have to be cleared. Here is a list of some
> possible candidates:
> 
>  *   269 and 429 (Mark Abraham seems to have a patches for those)
>  *   416 (all-vs-all)
>  *   432, 437, 441- windows (sse, GB)
>  *   443 (pdb2gmx fatal error)
> 
> Do all of those need to be resolved and is there anything else that should be
> cleared too?
> 
> Rossen
> 
> 
> On 6/2/10 11:24 PM, Rossen Apostolov wrote:
> To all developers,
> 
> The new release of Gromacs is coming close. Before releasing the new packages
> though, in the next couple of weeks until June 15:
> 
> * everything in bugzilla should be cleared (David already started
> exterminating :). If you see a bug that you can fix or help with, please do
> so.
> * if there are still any known issues, please file a bug asap or send a patch.
> * do not add any new features! Berk has some AmberFF stuff but apart from that
> everything new should wait for the next release
> * make sure that everything compiles without warnings on all platforms that
> you have access to
> 
> Hopefully all that will be done by the 15th and have a bug-free summer:)
> 
> Cheers,
> Rossen
> 




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