[Biojava-dev] Isoelectric point calculation alteration??

mark.schreiber at group.novartis.com mark.schreiber at group.novartis.com
Wed Feb 4 22:42:10 EST 2004


Hi Jonathan -

The last change was on Tue Jul 22 17:03:20 2003 it extended the search 
range to catch extreme pI values.

- Mark 





"Warren, Jonathan" <Jonathan.Warren at agresearch.co.nz>
Sent by: biojava-dev-bounces at portal.open-bio.org
02/04/2004 10:04 AM

 
        To:     <biojava-dev at biojava.org>
        cc: 
        Subject:        [Biojava-dev] Isoelectric point calculation alteration??


Hi

I've used the proteomics package in biojava recently and found that the
source code I had hasn't been modified since this mail in July last year
http://www.biojava.org/pipermail/biojava-dev/2003-July/000744.html maybe
someone could check that it has been changed as I can't easily access
CVS through our security

Important part of message here - relates to IsoelectricPointCalc.java  :

You're right. The problem is actually in the choice of bounds I used. It
expects an answer between 1-13 for pI. In this case, the answer is
probably beyond 13. I suggest using:- double pI =
BinarySearch.solve(0.3, 13.7, 0.001, computeObj); That's one heck of a
basic protein ;-) Regards, David Huen 



Jonathan Warren


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