Subject: RE: octanol-water partition coefficient calculations for peptides/small proteins

From: "Paul Hawkins" <phawkins*at*tripos.com>
Date: Thu, 2 Sep 2004 13:40:18 -0400

Leonardo,
 
Try HINT! from Glen Kellogg at VCU

.http://www.eslc.vabiotech.com/hint/ 

Paul.

  _____  

From: Computational Chemistry List [mailto:chemistry-request*at*ccl.net] On
Behalf Of LEDM (Leonardo De Maria)
Sent: Thursday, September 02, 2004 8:36 AM
To: CHEMISTRY*at*ccl.net
Subject: CCL:octanol-water partition coefficient calculations for
peptides/small proteins

Hi out there, 

can anyone point my attention to software to calculate the 
octanol-water partition coefficient calculations of 
peptides/small proteins (10-40 amino acids) besides PLOGP? 

It will be appreciated if they use 3D information for that 
purpose. 

Regards, 

Leonardo De Maria, PhD  Novozymes A/S 
Research Scientist 
Brudelysvej 26                  Bygning 1U.S25 
Protein Design                  2880 Bagsveard 
Molecular Biotechnology         Denmark                 
        +45 44421890 direct 
        +45 44980246 fax        
LeDM*at*novozymes.com               <file://www.novozymes.com>
www.novozymes.com