[Chimera-users] chimera to rebuild crystal

Miguel Ortiz-Lombardia molatwork at yahoo.es
Fri Jan 12 13:03:14 PST 2007

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Dear Tom,

Something that would be really good for crystallographers ( or at the
very least for this crystallographer ;-) ) is a way of getting the
symmetry related molecules that are in a certain radius of a selection.
As far as I know that is not possible now. I can get a full unit cell
and, if I recall it correctly, maybe a translated unit cell. While this
would in the end produce the symmetry related molecules around a
particular selection, being able to do it with a single command and
showing just those within that radius would be very helpful.

It's not an urgent need, just for your "wish-list" if it's not too full!

Big thanks to all the team for Chimera! And happy new year to everyone!


En/na Thomas Goddard ha escrit:
> Hi Brady,
>   I wrote a Python script that writes copies of a PDB model transformed
> to fill out a block of unit cells.  You can get it from the Chimera
> experimental features web page:
> 	http://www.cgl.ucsf.edu/chimera/experimental/experimental.html
> See the "details" link on that page for info about the script.
> 	Tom
> _______________________________________________
> Chimera-users mailing list
> Chimera-users at cgl.ucsf.edu
> http://www.cgl.ucsf.edu/mailman/listinfo/chimera-users

- --
Miguel Ortiz Lombardía
Centro de Investigaciones Oncológicas
C/ Melchor Fernández Almagro, 3
28029 Madrid, Spain
Tel. +34 912 246 900
Fax. +34 912 246 976
e-mail: molatwork at yahoo.es
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