Re: [AMBER] Error message while running alanine dipeptide tutorial (minimization)

From: David A Case <david.case.rutgers.edu>
Date: Fri, 4 Dec 2015 08:13:37 -0500

On Fri, Dec 04, 2015, Nikolay N. Kuzmich wrote:
>
> Actually, the inpcrd file does exist in folder
> /home/nikolay/amber14/dat/leap/prep/

Ooohh...don't put your working files inside the amber14 tree.

> The input file 01_Min.in is located at
> /home/nikolay/Tutorial/

The inpcrd file should be in the same place as the 01_Min.in file;
/home/nikolay/Tutorial sounds like a good place. The prmtop file should be
there as well.

...dac


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Received on Fri Dec 04 2015 - 05:30:05 PST
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