Re: [AMBER] corrplane in cpptraj and ptraj

From: Daniel Roe <daniel.r.roe.gmail.com>
Date: Thu, 27 Feb 2014 16:18:26 -0700

Hi,

On Thu, Feb 27, 2014 at 12:52 PM, Michael F. Bruist
<m.bruist.usciences.edu>wrote:

>
> In both ptraj and cpptraj I do not get an output file and I get the
> message:
>
> Warning: Output of corr, ired, corrired or corrplane vectors is not yet
> supported!
>

You are using an out-of-date version of cpptraj. Make sure the output of
'cpptraj --version' reads V13.22.


>
> vector corr plane :6.N1.C2,N3,C4,C5,C6 out U6_plane.vec
>

I don't think you want the period after the N1.

-Dan


-- 
-------------------------
Daniel R. Roe, PhD
Department of Medicinal Chemistry
University of Utah
30 South 2000 East, Room 201
Salt Lake City, UT 84112-5820
http://home.chpc.utah.edu/~cheatham/
(801) 587-9652
(801) 585-6208 (Fax)
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Received on Thu Feb 27 2014 - 15:30:02 PST
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