Re: [AMBER-Developers] final (!?!) release candidate for Amber11

From: Volodymyr Babin <vbabin.ncsu.edu>
Date: Thu, 15 Apr 2010 14:26:17 -0400 (EDT)

Hi,

I have no idea, but it works better for me (see the wiki). In
case you did not look there, please check my BSD tests as there
are two easily fixable issues with sander_pbsa_frc and mmpbsa_py.

Best,

Volodymyr

On Thu, April 15, 2010 14:02, Jason Swails wrote:
> Hello,
>
> Is the following common for trying AmberTools parallel with
> DO_PARALLEL="mpirun -np 4" ?
>
>
> Finished test suite for parallel AmberTools (ptraj) at Thu Apr 15
> 14:00:08 EDT 2010.
>
>
> Finished test suite for AmberTools at Thu Apr 15 14:00:08 EDT 2010.
>
> make: Target `test.parallel2' not remade because of errors.
> 13 file comparisons passed
> 15 file comparisons failed
> 5 tests experienced errors
>
> All the best,
> Jason
>
>
> On Thu, Apr 15, 2010 at 7:39 AM, <steinbrt.rci.rutgers.edu> wrote:
>> Hi everyone,
>>
>> here (fedora11, x86_64 (Intel Quadcore 2.66GHz), intel compiler suite
>> 11.1.059, with openmpi-1.4.1) both AT alone and with A11 compile fine.
>> The
>> only test failures I see are:
>>
>> tip5p (both serial/parallel) in amber
>> the rism1d path typo in AT (already noted by Jason).
>>
>> I noticed that the ti_decomp_sc test case is still uncommented, but it
>> passes for me now.
>>
>> Kind Regards,
>>
>> Thomas
>>
>> Dr. Thomas Steinbrecher
>> BioMaps Institute
>> Rutgers University
>> 610 Taylor Rd.
>> Piscataway, NJ 08854
>>
>> _______________________________________________
>> AMBER-Developers mailing list
>> AMBER-Developers.ambermd.org
>> http://lists.ambermd.org/mailman/listinfo/amber-developers
>>
>
>
>
> --
> ---------------------------------------
> Jason M. Swails
> Quantum Theory Project,
> University of Florida
> Ph.D. Graduate Student
> 352-392-4032
>
> _______________________________________________
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> AMBER-Developers.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber-developers
>


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Received on Thu Apr 15 2010 - 11:30:05 PDT
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