Re: [AMBER] ptraj, outprefix not giving a stripped prmtop

From: Jason Swails <jason.swails.gmail.com>
Date: Tue, 23 Jul 2013 16:58:12 -0400

On Jul 23, 2013, at 4:40 PM, Hunter Brown <bassoongoon.earthlink.net> wrote:

> I have included here my ptraj script:
>
> trajin MD_prod1.mdcrd 1 2500 5
> trajin MD_prod2.mdcrd 1 2500 5
> trajin MD_prod3.mdcrd 1 2500 5
> trajin MD_prod4.mdcrd 1 2500 5
> strip :WAT outprefix strip
> center origin :MET
> image origin center familiar
> trajout 2foldposionized.mdcrd
> go
>
>
> It produces the file 2foldposionized.mdcrd, but fails to produce the strip.prmtop file.
>
> I do not think that my usage is incorrect, but it might be.
>
>
> Is there something wrong with my script?

Only cpptraj recognizes this keyword.

HTH,
Jason

>
>
> Thanks in advance,
>
> -Hunter
>
> Hunter Brown
> Bassoonist, Contrabassoonist, Composer, Chemical Engineering Major
> University of New Mexico
>
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> AMBER.ambermd.org
> http://lists.ambermd.org/mailman/listinfo/amber

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Received on Tue Jul 23 2013 - 14:00:04 PDT
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