[phenixbb] pdbtools: how to set the occupancy for an atom selection?

Chen Zhao c.zhao at yale.edu
Mon Apr 13 07:01:42 PDT 2015


Hi Alex,

There is an option "occupancies.set=0". Hope this helps!

Best,
Chen

On Mon, Apr 13, 2015 at 9:46 AM, Alejandro Virrueta <
alejandro.virrueta at yale.edu> wrote:

> Hello,
>
> I was wondering if someone could show me a way to set the occupancy of a
> specific set of atoms to 0 using phenix.pdbtools.
>
> I noticed here
> <https://urldefense.proofpoint.com/v2/url?u=http-3A__www.phenix-2Donline.org_download_documentation_cci-5Fapps_pdbtools.html-23anch2&d=AwMFaQ&c=-dg2m7zWuuDZ0MUcV7Sdqw&r=uV9bK9zAIvRZlk7q6-YllA&m=87qSRfQW1CF7Y8dPbUwv6L-pEFJx7zkKKAGsjVS09c0&s=NAHtEINOsS50QpVDKV-8_cB2290WJzzmSscacsNddls&e=> that
> there is no option under modify => occupancies to do an 'atom_selection'. Any
> help would be appreciated.
>
> Cheers,
> Alex
>
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