[gmx-users] LJ14 parameters

Xavier Periole periole at inka.mssm.edu
Sat May 11 00:17:47 CEST 2002

Hi all,

I am creating a new "residue" using atom types allready existing.
But the LJ14 parameters are not defined between those atom types.

the question is :
Is there any general rule to determine the LJ14 from the LJ ?
Are they pbtained duringthe parametrisation process ?



Xavier Periole
Mount Sinai School of Medicine-NYU
New York

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