Re: [AMBER] Xparmed.py

From: David A Case <case.biomaps.rutgers.edu>
Date: Wed, 24 Sep 2014 10:49:23 -0400

On Wed, Sep 24, 2014, Arun Srikanth wrote:
>
> I want to see only angles that contain both "1 and 2" with all the other
> atoms. I am not sure how to set the mask for this
>
> .1-2 or @1.2 implements atom 1 or atom 2. But I want @1 and @2.

Simple answer to to use the masks above, then post-process the output to
remove lines that don't involve both atoms.

...dac


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Received on Wed Sep 24 2014 - 08:00:04 PDT
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