AMBER Archive (2008)

Subject: Re: AMBER: ASSERTion ' ier == 0 ' failed in nmode.f

From: David A. Case (case_at_scripps.edu)
Date: Thu Apr 10 2008 - 00:03:14 CDT

On Wed, Apr 09, 2008, Qi Yan wrote:
>
> Maximum nonbond pairs 35934002
> ASSERTion ' ier == 0 ' failed in nmode.f at line 106.
>
>
> I checked mailing list and found some people got the same problem
> before. This belong to memory issue. In addition to increase memory,
> some people said they just cut off some parts which are far away from
> binding region or change ismem=1 in the input file without calculating
> eigenvectors.

These are all reasonable suggestions....good luck...dac

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