[Chimera-users] External SAS calculation
Elaine Meng
meng at cgl.ucsf.edu
Tue Nov 10 08:40:19 PST 2009
Hi Yasser,
The probe radius is also needed for the SES (solvent-excluded
surface), which is the one displayed in Chimera. As Tom mentioned,
the SES is where the surface of the probe goes, while the SAS is where
the center of the probe goes. Both SAS and SES area calculations
require and depend on the probe radius. It is only the SAS triangles
for drawing the surface, the locations of the SAS surface points, that
are not calculated. So if you were planning to save the surface
points, you could only get the ones for the SES.
This is true for the currently available Chimera. We are planning to
make some changes in the surface calculations, so it may change in the
future.
I hope this helps,
Elaine
On Nov 10, 2009, at 6:49 AM, Yasser Almeida Hernández wrote:
> Hi Tom...
> I'm actually interested in compute and save the accesible surface as
> a grid (like DMS).
> If Chimera doesn't compute the SAS surface (with MSMS code), why it
> ask for the probe radius in Favorites > Preferences > New Surfaces?
>
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