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[ESPResSo-users] directional lenard jones

From: mehdi ezatabadi
Subject: [ESPResSo-users] directional lenard jones
Date: Wed, 4 Jul 2012 12:21:44 +0430


Thank you to introduce me this potential, I implemented it, just one question :

In this potential you should determine  two bonded neighbors ba1,........ . There is a little problem in the last site of every polymer. It just has one bonded neighbor.

May I ask how could I rectify this problem ? Thanks for your potential , its really helpful for me and simplifies my model.

I want to add a virtual site to the end of every tail, I dont know it is really helpful or not.

Thanks, Mohammad

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