[Chimera-users] turning ksdssp off?
Eric Pettersen
pett at cgl.ucsf.edu
Mon Mar 15 16:17:10 PDT 2010
Hi Sumitro,
The shortest answer is no, there is no way (barring some Python
shenanigans). You could clear SS assignments afterward with:
setattr r isHelix false #
setattr r isStrand false #
Can you describe why you want to turn off the SS computation? We
might make it optional somehow if it was of general use.
--Eric
Eric Pettersen
UCSF Computer Graphics Lab
http://www.cgl.ucsf.edu
On Mar 14, 2010, at 6:54 AM, Sumitro Harjanto wrote:
> Hi,
>
> Is there any way to turn off automatic secondary structure
> assignment upon opening a pdb file that does not contain secondary
> assignments?
>
> Cheers,
> Sumitro
>
> ---------------------------------------------------------------------------------------------------------------------------------------------
> …
> Opening B-7301_SRWGYQVKH_1K5N.pdb...
> Computing secondary structure assignments...
> Computed secondary structure assignments (see reply log)
> Model 2 (B-7301_SRWGYQVKH_1K5N.pdb) appears to be a protein without
> secondary structure assignments.
> Automatically computing assignments using 'ksdssp' and parameter
> values:
> energy cutoff -0.5
> minimum helix length 3
> minimum strand length 3
> Use command 'help ksdssp' for more information.
> …
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