AMBER Archive (2003)

Subject: Re: NOESY restraints

From: David A. Case (case_at_scripps.edu)
Date: Fri Jun 20 2003 - 19:49:00 CDT

On Fri, Jun 20, 2003, Teletchéa Stéphane wrote:
>
> Namelist reports error in reading noeexp
> -- Subscript out of range implies dimensioning
> problem
> -- (see nmr.h and sizes.h, SIZE_NMR_PCY if nmr stuff)
>
> I've compiled amber several times nmr.h and sizes.h
> increasing parameters, but error is still there...

The message does not necessarily mean that you have a dimensioning error; that
is just one of several possibilities. I don't see anything wrong with
your input, but it wasn't all there.

The usual thing is to build ever-larger RST files, starting with something
very small that gets accepted, and figuring out from there what the
problem is. You might also try to run on other systems that give better
error reporting.

..good luck...dac 

-- 

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David A. Case                     |  e-mail:      case_at_scripps.edu
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