VMD-L Mailing List

From: mishacat_at_udm.ru
Date: Tue Sep 09 2008 - 01:30:05 CDT

Hi everyone!
I need to generate a large quantity of the same molecules.
I used this script:

set segname A
for {set segid 0} {$segid < 999} {incr segid} {
     set pdb $prefix.pdb
     set seg $segname$segid
     segment $seg {
         pdb $pdb
     }
     coordpdb $pdb $seg
}

but segid cannot be larger than 999. The question is: how to organize "for" cycle from "A" to "Z"?
Any other approaches of generating large quantity of molecules are welcome. 

--
Sincerely yours,
Mikhail Suyetin    
--
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