VMD-L Mailing List
From: Josh Vermaas (vermaas2_at_illinois.edu)
Date: Sat Feb 22 2014 - 17:49:43 CST
You are very close. noh and exwithin 0.5 of noh. "exwithin" is basically
the "within" keyword, but an atom is excluded from its own within list.
On 02/21/2014 09:56 PM, Jacob Durrant wrote:
> Hi all. Is there an atom selection to identify steric clashes? At
> first I thought something like "noh within 0.5 of noh" might work, but
> each atom is identified as being very near itself, so this section
> ends up being equivalent to "all".
> Jacob D. Durrant <https://amarolab.ucsd.edu/%7Ejdurrant/>, PhD
> Rommie E. Amaro Research Group <https://amarolab.ucsd.edu/>
> University of California, San Diego
> Connect with me on LinkedIn
> jacobdurrant_at_gmail.com <mailto:jacobdurrant_at_gmail.com>
> jdurrant_at_ucsd.edu <mailto:jdurrant_at_ucsd.edu>