RE: [PyMOL] default atomic radii

[Warren L. D. <wa...@de...>]

Scott,

	Currently they are hard-coded in the C, but can be changed after
loading the molecule using:

alter selection, vdw=number

for example:

alter elem c, vdw=1.8
alter elem n, vdw=1.4
alter elem h, vdw=1.1


etc.

Cheers,
Warren


--
mailto:wa...@de...
Warren L. DeLano, Ph.D.
Principal Scientist
DeLano Scientific LLC
Voice (650)-346-1154 
Fax   (650)-593-4020

> -----Original Message-----
> From: pym...@li... [mailto:pymol-users-
> ad...@li...] On Behalf Of Scott Classen
> Sent: Friday, June 20, 2003 12:56 PM
> To: pym...@li...
> Subject: [PyMOL] default atomic radii
> 
> Hi Warren,
> What are the default atomic radii in PyMol? How are they
> calculated/determined?
> Thanks,
> Scott Classen
> 
> 
> ==============================================
>    Scott Classen, Ph.D.
>    cl...@uc...
>    University of California, Berkeley
>    Department of Molecular & Cell Biology
>    237 Hildebrand Hall #3206
>    Berkeley, CA 94720-3206
>    LAB 510.643.9491
>    FAX 510.643.9290
> ==============================================
> 
> 
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