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,
Jianhui
tianj.rpi.edu
2006-09-15
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Received on Sun Sep 17 2006 - 06:07:23 PDT
