Re: [AMBER] Ambertools16 test failed for leap

From: David A Case <david.case.rutgers.edu>
Date: Sun, 5 Jun 2016 06:46:51 +0200

On Sat, Jun 04, 2016, zoran matovic wrote:
>
> However, when we installed Ambertools16 and made a test by
> command “make test” serial ambertools reported 6 failed file
> comparisons. I attached them here. Among them the leap test in case of
> “amber16/AmberTools/test/leap/4PY5 “ produce concerning difference (see
> attached difff file) in MPHIA and NPHIA number of dihedrals. CUDA test
> went smoothly without failed jobs.

I can confirm the problem. We are looking into this, and will post an update
as soon as we figure out what is going on.

Thanks for the report.

...dac


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Received on Sat Jun 04 2016 - 22:00:02 PDT
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