[gmx-users] Lennart Jones only

Markus O Kaukonen mokaukon at cc.helsinki.fi
Thu Nov 29 08:35:32 CET 2001


Dear all,

Is it possible to get Lennart Jones (Buckinham) interaction ONLY
and switch off all other interactions by just manipulating input
files (cutoffs???) without touching the source code?

I would like to get the Lennart Jones (Buckinham) total energy and
forces.

Cheers, Markus

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