All,

I am attempting to write up a structure biology proposal for the  
NIH...and just trying to establish JMol capabilities here.

Would you al agree that the following function does not exist in Jmol?

1 Select residues in a protein's catalytic group
2 Note positions relative to each other
3 Search all of PDB, for that spatial arrangement of residues
4 Return back list of of PDB IDs with rms deviation, as a table

This is basically blast but for structure. I've gotten some static  
from review about this but I think a plug in would be really welcomed.  
Its sequence agnostic. What do you think? If we could get funding for  
this, it would add to the developer squad already on the team. Let me  
know please. I'm not talking about SYBYL, I'd like something for the  
masses to use easily...Highlight three things and press a button to  
launch.

Further I'd like the spirit of this request to remain open source  
please, but the idea is mentioned in straight up confidence to this  
group and is already written up, so no poaching  eh? We all have a lot  
on our plates but JMol is a really good effort I'd like to support.

Cheers,

Chris Larsen


-- 
** Vecna's Maryland office moved 11/6/08.
My new phone, fax, and address are below.**

Christopher Larsen, Ph.D.
Sr. Scientist / Grants Manager
Vecna Technologies
6404 Ivy Lane #500
Greenbelt, MD 20740
Phone: (240) 965-4525
Fax: (240) 965-4507
240-737-1625


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