Re: [AMBER] AMBER Digest, Vol 2256, Issue 1

From: Sehrish Naz <sehrish.naz.outlook.com>
Date: Tue, 10 Apr 2018 14:01:01 +0000

I am replying to all, I have CC Amberlist in every mail.

There is no error in the output files prod0.rst is normal from which I am trying to generate prod1.rst and job halted on its own without any error. Just a single error in nohup.out file i.e.

Starting Script at: Tue Apr 10 08:30:13 PKT 2018

Job 1 started at: Tue Apr 10 08:30:13 PKT 2018

-inf: Command not found.

4_prod1.mdcrd: 10.3% -- replaced with 4_prod1.mdcrd.gz

Job 1 finished at: Tue Apr 10 08:32:11 PKT 2018

Job 2 started at: Tue Apr 10 08:32:11 PKT 2018

At line 138 of file inpcrd_dat.F90 (unit = 9, file = '4_prod1.rst')

Fortran runtime error: End of file

I am not getting it. I will appreciate if some one can guide me?

Thanks in advance



Regards,

Sehrish



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________________________________
From: David A Case <david.case.rutgers.edu>
Sent: Tuesday, April 10, 2018 3:25:39 PM
To: Sehrish Naz
Subject: Re: AMBER Digest, Vol 2256, Issue 1

On Tue, Apr 10, 2018, Sehrish Naz wrote:
> Dear Dac,

Please send amber-related questions to the mail reflector, amber.ambermd.org,
and not to me personally. That way, many people can see your question and try
to help, and the answers can help others with similar questions. See
http://lists.ambermd.org/mailman/listinfo/amber for information on how to
subscribe.
>
>
>
> The job halted on its own in the mid of MD cycles without showing any
> error notification in .out or .rst file. I just have got the following
> error in only nohup.out file;
>
> At line 138 of file inpcrd_dat.F90 (unit = 9, file = '4_prod1.rst')
> Fortran runtime error: End of file

You want to look for the error in the previous job (the one where
4_prod1.rst was the *output* file, not the input file.)

....dac

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Received on Tue Apr 10 2018 - 07:30:02 PDT
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