Re: [AMBER-Developers] why are all the pmemdTI tests failing?

From: Josh Berryman <>
Date: Thu, 18 Dec 2014 14:18:55 +0100

Fresh checkout is fine for me.

configure is: GNU, openMPI.
machine is: 64 bit ubuntu, intel CPUs.

from an output file:

| Conditional Compilation Defines Used:


On 18 December 2014 at 13:41, David A Case <> wrote:

> I'm hoping someone can look into this: for me, all the pmemdTI tests are
> failing. The jobs run fine, but the final breakdown of DV/DL into pieces
> (section headed "DV/DL, AVERAGES OVER n STEPS") gives all zeroes.
> This on the master branch, and a Mac with gcc 4.9. If it works for you on
> some other platform, please post info, since that would be a help. Or, if
> there is someone more familiar with the code than I am, that would also be
> great.
> In general, we need to start cleaning up the test cases, in preparation for
> the upcoming developers' meeting. There are also test failures (at least
> for
> me) in the ti_decomp sander tests and the softcore/dnylmb tests.
> ...thx...dac
> _______________________________________________
> AMBER-Developers mailing list
AMBER-Developers mailing list
Received on Thu Dec 18 2014 - 05:30:06 PST
Custom Search