[gmx-users] the radius of dry core

Dallas Warren Dallas.Warren at monash.edu
Mon May 7 00:56:18 CEST 2012

Via the methylene - COM RDF.

Catch ya,

Dr. Dallas Warren
Medicinal Chemistry and Drug Action
Monash Institute of Pharmaceutical Sciences, Monash University
381 Royal Parade, Parkville VIC 3010
dallas.warren at monash.edu
+61 3 9903 9304
When the only tool you own is a hammer, every problem begins to resemble a nail.

From: gmx-users-bounces at gromacs.org [mailto:gmx-users-bounces at gromacs.org] On Behalf Of dina dusti
Sent: Sunday, 6 May 2012 3:42 PM
To: gmx-users at gromacs.org
Subject: [gmx-users] the radius of dry core

Dear GROMACS Specialists,

I am working about micelles and have a question about the radius of dry core.
May I ask you to answer me, Please?
In one paper, I saw that the radius of dry core equals "where the density profiles of water and the surfactant hydrocarbon tails cross and a fraction of about 0.78 methylenes are found to be within this distance to COM".
I don't know how I obtain the fraction of methylenes in this distance to COM!
Please help me.

Thank you very much in advance.
Best Regards
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