Re: [AMBER] how can i remove this error

From: Bill Ross <ross.cgl.ucsf.edu>
Date: Sun, 2 Jul 2017 13:55:18 -0700

Use an atom name from the atom names in your molecule. Evidently 'FE'
isn't among them.

Bill


On 7/2/17 1:53 PM, Rana Rehan Khalid wrote:
> hello everyone i have prep file for heme when i try to produce the parm
> file from heme prep file with this command
>
> parmchk -i argn.in -f prepi -o sin.frcmod
>
> this error come
>
> FE in the LOOP section is not a valid atom name
>
> kindly guide what can i do. thanks
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Received on Sun Jul 02 2017 - 14:00:03 PDT
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