Re: [AMBER] cpptraj average structure warning

From: George Tzotzos <gtzotzos.me.com>
Date: Thu, 17 Dec 2015 11:22:12 +0100

Please disregard this message.

Apologies for the inconvenience

George

> On 17 Dec 2015, at 10:05, George Tzotzos <gtzotzos.me.com> wrote:
>
> I’m using the following script to determine the average structure chain A of a homodimer (250 residues)
>
> parm complex_solv.prmtop
> trajin prod_0-100ns.nc
> rms first mass .C,CA,N :1-125
> average chA-average.db pdb
>
> Warning: Setup failed for [rms first mass @C,CA,N :1-125]: Skipping
> 1: [average chA_averaged.pdb pdb]
>
> I’d appreciate any explanation with regard to this warning
>
> Regards
>
> George
>
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Received on Thu Dec 17 2015 - 02:30:02 PST
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