[gmx-users] g_rdf calculations for monolayer
Sriprajak Krongsuk
sprajakk at yahoo.com
Sun Aug 21 10:04:02 CEST 2005
Dear Users
I have some problem about g_rdf calculation for monolayer system.
My system is porphyrazine monolayer at air-water interface. I tried to calculate the rdf for water around the center of mass of porphyrazine, but the result is still not nomalized. I mean it does not goes to 1 at the long distance.
My questions are that
(1) Can I use g_rdf for calculating such a system
(2) If I can, how should I do to get normalized rdf?
Best wish,
Mr. Sriprajak Krongsuk
Physics Department
Faculty of Science
Mahidol University
Bangkok, Thailand 10400
E-Mail: sriprajak at hotmail.com
sprajakk at yahoo.com
Tel. 01-2620095
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