Re: [AMBER-Developers] Amber test concerns

From: Jason Swails <jason.swails.gmail.com>
Date: Thu, 20 Jan 2011 20:47:01 -0500

Great! I love passing tests.

On Thu, Jan 20, 2011 at 7:47 PM, Mengjuei Hsieh <mengjueh.uci.edu> wrote:

> On Wed, Jan 19, 2011 at 06:12:27PM -0500, Jason Swails wrote:
> > I've tested both Amber and AmberTools from a recent git checkout and I've
> > summarized what I think the major issues are below:
> > sander_pbsa_ipb2 && ./Run.110D.min -- some numbers are significantly
> > different, but it may be benign
>
> I just pushed a verified version of pbsa test cases, that should solve
> some of the issues.
>
> Tested on i386 linx / x86_64 Mac OS X with gfortran / intel fortran.
>
> Best,
> --
> Mengjuei
>
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>



-- 
Jason M. Swails
Quantum Theory Project,
University of Florida
Ph.D. Graduate Student
352-392-4032
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Received on Thu Jan 20 2011 - 18:00:04 PST
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