[Dock-fans] Radius of spheres in 'generating spheres'
Scott Brozell
sbrozell at scripps.edu
Thu Oct 30 12:34:46 PDT 2008
Hi,
On Wed, 29 Oct 2008, Donna wrote:
> I am generating my spheres manually from the coordinates I already have and would like to know what the default setting should be for the radius of spheres? e.g. I was thinking would 3 be a reasonable default?
>
Reiterating
http://blur.compbio.ucsf.edu/pipermail/dock-fans/2008-October/001755.html
I don't see ANY use of the sphere radii.
So try various ones and please send us a report.
> or,
>
> Is there a recommended radius for spheres representing donors, acceptors, hydrophobic, donor/acceptor, polar etc when using chemical matching?
>
I do not know. The arts of some forms of DOCKing have been lost,
hopefully only temporarily.
Scott
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