AMBER Archive (2008)

Subject: Re: AMBER: INPCRD error on open

From: Carlos Simmerling (carlos.simmerling_at_gmail.com)
Date: Thu Mar 20 2008 - 10:22:56 CDT


it might help if you send your sander script so we can see
what you specified. without that we can only guess.
do you actually have a file called "inpcrd" in that directory?

On Thu, Mar 20, 2008 at 11:17 AM, Campbell, Patrick <pcampbell_at_msm.edu>
wrote:

> A pleasant good morning to all,
>
> I am getting the following error from the mdout file after a failed
> minimization run on a neutralized hydrated protein.
>
> 1. RESOURCE USE:
> ------------------------------------------------------------------------
> --------
> | Flags: MPI
> getting new box info from bottom of inpcrd
> Unit 9 Error on OPEN: inpcrd
>
> Can anyone suggest a possible strategy towards the correction of this
> problem?
>
> Thanks much.
> Patrick
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