Re: [AMBER-Developers] Third release candidate for AmberTools 1.5

From: David A Case <>
Date: Mon, 28 Mar 2011 16:13:12 -0400

On Mon, Mar 28, 2011, Ben Roberts wrote:

> nab/asp.out

You diff file indicates a very serious problem. Can you edit the
$AMBERHOME/AmberTools/test/nab/Run.asp file and comment out lines 15 and 16
(that truncate the output file), re-run the test and post the asp.out.tmp

If you have time, it would be of interest to see what happens without MKL.

> nab/aspnb.out
> nab/asp_nm1.out

These two are also bad errors, but probably have the same cause as the first
one, so don't worry about them for now.

> sqm/ch3f/ch3f.pm6.go.out

I'm aware of this one (shows up on Linux as well).


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Received on Mon Mar 28 2011 - 13:30:06 PDT
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