[gmx-users] GROMACS-4.5-beta1 is out!

ms devicerandom at gmail.com
Mon Aug 2 14:31:58 CEST 2010

On 01/08/10 22:03, Rossen Apostolov wrote:
> On 07/31/2010 10:17 PM, ms wrote:
>> As a young GROMACS user, thank you a lot! I just want to ask:
>> On 30/07/10 20:20, Rossen Apostolov wrote:
>>> * Efficient Generalized-Born implicit solvent support including the
>>> Still/HCT/OBC-models to compute the Born radii, a novel way of
>>> tabulating the generalized Born-interaction formula for greater
>>> speed, and optimized SSE-routines for both cut-off and all-vs-all
>>> simulations.
>> - Is there a 4.5 version of the manual which documents the implicit
>> solvent feature?
>> - It is already tested enough that one can be comfortable (albeit
>> cautious) using it for real work, or does it require a lot of testing,
>> in your opinion?
>> thanks again!
>> m.
> As far as I know it's production ready code, but still - this is a beta
> release so I would do some local testing first.
> I've put an updated version on the website:
> http://www.gromacs.org/Documentation/Manual
> Here is the direct link:
> http://www.gromacs.org/@api/deki/files/101/=manual-4.5-beta1.pdf

thank you very much!


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