Re: AMBER: Problem with mask when using distance in ptraj

From: David A. Case <case.scripps.edu>
Date: Wed, 22 Nov 2006 13:07:29 -0800

On Wed, Nov 22, 2006, Christopher Gaughan wrote:

> Mask [.CA:244] represents 0 atoms !!!NO ATOMS DETECTED!!!

You can use the ambmask command to play around with various masks to get
what you want. Have you tried ':544.CA'? All the examples in the Users'
Manual have the residue specification to the left of the atom specification,
and maybe that is required(?).

....good luck....dac

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Received on Wed Nov 22 2006 - 23:01:55 PST
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