If anyone has access to the PGI compilers, bits of AmberTools aren't
compiling for me out-of-the-box on athena, but there are enough
Cray-specific idiosyncrasies that I'm not confident enough to label them PGI
problems.
Also, for those of you who will try building this alongside Amber11 (dirty
or clean), don't forget to apply the script AT15_Amber11.py after configure
(from any directory, it just uses absolute paths based on AMBERHOME).
Configure should print a warning message about this in any case.
All the best,
Jason
On Mon, Mar 14, 2011 at 12:03 PM, David A Case <case.biomaps.rutgers.edu>wrote:
> Hi everyone:
>
> The second "release candidate" for AmberTools 1.5 is here:
>
> http://ambermd.org/downloads/AmberTools.14mar11.tar.bz2
>
> Please test this out:
>
> a. on its own
> b. in conjunction with Amber11 (either in a clean install, or untarred
> on top of a working, "dirty" directory already containing AT 1.4.)
>
> It is better to test this than the at15-with-patches branch, since this is
> what users would actually be getting. No GEM here yet, but other things
> should be getting close.
>
> ...thx...dac
>
>
> _______________________________________________
> 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. Candidate
352-392-4032
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Received on Mon Mar 14 2011 - 13:00:04 PDT
