Re: [AMBER] Running a small minimization with amber 16 package

From: David A Case <david.case.rutgers.edu>
Date: Tue, 31 Jul 2018 14:33:06 -0400

On Tue, Jul 31, 2018, Debarati DasGupta wrote:
>
> Unit 9 Error on OPEN: min_restrain.rst

What are the results of the following commands?

   ls -l min_restrain.rst
   file min_restrain.rst

Usually, an open error means the file is not present, or you do not have
permissions to read it. The format of the file should not be a problem,
since it is auto-detected. (You could try an experiment where you use
nxto=1 in the restrained minimization step. Then you could examine the
file with a text editor. But I don't think this will do any good.)

....dac


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Received on Tue Jul 31 2018 - 12:00:03 PDT
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