[Chimera-users] accessible surface area for electron density maps
Elaine Meng
meng at cgl.ucsf.edu
Fri Mar 27 09:57:47 PDT 2009
Hi Murali,
As far as I know, there is no definition of accessible surface area
for an electron density map (and thus no way to calculate it in
Chimera), only for atomic structures. I'll describe how to get it
for atomic structures in my next message, replying to David.
Best,
Elaine
-----
Elaine C. Meng, Ph.D. meng at cgl.ucsf.edu
UCSF Computer Graphics Lab (Chimera team) and Babbitt Lab
Department of Pharmaceutical Chemistry
University of California, San Francisco
http://www.cgl.ucsf.edu/home/meng/index.html
On Mar 27, 2009, at 8:18 AM, Murali Ayaluru wrote:
> Hi Elaine,
>
> Thanks for the quick reply. I am aware of calculating the total
> surface area of the density maps using Chimera and has been using
> it for a long time. Now I am interested in the surface area that a
> solvent can access (in otherwords called - (solvent) accessible
> surface area). This is a part of the total surface area. Please
> mail me if this tool is available in Chimera.
>
> Regards,
> Murali
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