(unknown charset) Re: AMBER: Clarification on error message

From: (unknown charset) Thomas Steinbrecher <steinbrt.scripps.edu>
Date: Sat, 8 Mar 2008 12:17:35 -0800 (PST)

Hi Patrick,

did you specify a reference coordinate file with the -ref switch in your
sander command? If yes, is that file present and readable to your process?
Did you set ntr=1 in your mdin file so that sander expects a reference



Dr. Thomas Steinbrecher
The Scripps Research Institute
10550 N. Torrey Pines Rd.
San Diego CA 92037, USA

On Sat, 8 Mar 2008, Campbell, Patrick wrote:

> Good Morning AMBER Analysts,
> I have an error in a minimization output file which I was hoping you would clarify.
> Unit   10 Error on OPEN: refc
> I have attached the output file for reference.
> Thanks for your assistance and do have a great day!
> Patrick
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Received on Sun Mar 09 2008 - 06:07:54 PDT
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