Hai pointed out a problem with GCC 4.1.2 compatibility that I just fixed.
The RC download has been updated and the md5sum is
c3137b9cd75772521b51b728e132f6c0
If you have already downloaded the last copy, the only difference is in
AmberTools/src/sander/ncsu-cv-MULTI-RMSD.F90 where I changed __GFORTRAN to
__GFORTRAN__.
Sorry for the inconvenience,
Jason
On Wed, Apr 15, 2015 at 3:46 PM, Jason Swails <jason.swails.gmail.com>
wrote:
> Hi everyone,
>
> Yet more errors, round-off failures, and bugs have been fixed since our
> last release candidate. My most recent tests show that everything builds
> correctly and passes in both serial and parallel. So I've prepared what I
> hope is our final release candidate before we officially release AmberTools
> 15.
>
> So please download the latest release candidate:
>
> http://ambermd.org/rc_downloads/AmberTools15.15apr15.tar.bz2
>
> compile it, run the tests, and report your results on the Wiki. What we
> really need tested:
>
> - PGI compilers
> - Testing *with* Amber 14
> - Older GCC compilers (specifically 4.1.2 as is used in RHEL 5)
>
> Thanks!
> Jason
>
> On Mon, Apr 6, 2015 at 3:33 PM, Jason Swails <jason.swails.gmail.com>
> wrote:
>
>> Hello again,
>>
>> A number of minor test failures and a couple more significant bugs have
>> been fixed since the last release candidate. So I've created a new one
>> that you can download here:
>>
>> *http://ambermd.org/rc_downloads/ <http://ambermd.org/rc_downloads/>*
>> AmberTools15.06apr15.tar.bz2
>> <http://ambermd.org/rc_downloads/AmberTools15.06apr15.tar.bz2>
>>
>> Same general requests as last time: please test as much as you can. I'm
>> hoping that we are nearing the final revisions, so it would be
>> especially helpful if more people would download and test the code as
>> well as report the results on the Wiki.
>>
>> The more people we can get to run the tests, the better our final
>> version should be.
>>
>> Manual improvements (even just reports of parts that are unclear or
>> misleading) are also appreciated (but please do not document stuff that
>> will not be part of AmberTools 15 yet).
>>
>> Thanks,
>> Jason
>>
>> On Tue, 2015-03-31 at 14:07 -0400, Jason Swails wrote:
>> > Hi everyone,
>> >
>> >
>> > We are nearing our targeted release date in April for AmberTools 15.
>> > I've created the first release candidate that can be found
>> > here: http://ambermd.org/rc_downloads/AmberTools15.31mar15.tar.bz2
>> >
>> >
>> > Please download the release candidate and test it on as many platforms
>> > (with as many compilers) as you have access to (it is not the same as
>> > git). In particular, the compilers we purport to support are:
>> >
>> >
>> > gnu (gcc, g++, gfortran)
>> > intel (icc, icpc, ifort)
>> > pgi (pgcc, pgCC, pgf90)
>> > clang (clang, clang++, gfortran)
>> >
>> >
>> > And some lesser-tested (and not-advertised) targets:
>> >
>> >
>> > cray (cc, CC, ftn)
>> > open64 (opencc, openCC, openf90)
>> >
>> >
>> > We also want to make sure that AmberTools 15 works both with Amber 14
>> > and as a standalone package, so if you can test AmberTools 15 both
>> > with and without Amber 14, that would be great. And testing the MPI
>> > and OpenMP parallel builds is appreciated as well.
>> >
>> >
>> > So if you can, please download the tarball, build it with/without
>> > Amber 14, with MPI and OpenMP, and post the results of the test suite
>> > on the Amber
>> > wiki: http://ambermd.org/pmwiki/index.php/Main/Amber15Test (if you
>> > forget the password to edit, please feel free to contact me for it).
>> >
>> >
>> > Thanks!
>> > Jason
>> >
>> >
>> > --
>> > Jason M. Swails
>> > BioMaPS,
>> > Rutgers University
>> > Postdoctoral Researcher
>>
>> --
>> Jason M. Swails
>> BioMaPS,
>> Rutgers University
>> Postdoctoral Researcher
>>
>>
>
>
> --
> Jason M. Swails
> BioMaPS,
> Rutgers University
> Postdoctoral Researcher
>
--
Jason M. Swails
BioMaPS,
Rutgers University
Postdoctoral Researcher
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Received on Wed Apr 15 2015 - 16:00:03 PDT
