AMBER: About Lennard-Jones Parameters

From: Jianhui <>
Date: Fri, 15 Sep 2006 17:08:13 -0400

Hello amber-users,

In parm99.dat file, listed are the van der waals radius sigma and the well depth epsilon of different elements, which is used for the same element Lennard-Jones interactions such as O-O. How do AMBER calculate the Lennard-Jones parameters for different element interaction such as Na-O? Thanks a lot in advance.

Best regards,

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Received on Sun Sep 17 2006 - 06:07:23 PDT
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