[gmx-users] virtual site, dummy massive site LJ interactions
fpoosaneh at gmail.com
Sat Nov 18 14:29:01 CET 2017
I have 2 questions please. They seem evident, but I need to be sure to
solve my simulation problem:
1- Does being a virtual site (charge, no mass) or a normal atom, effects on
its LJ interaction energies with rest of system?
2- Does adding a dummy massive site (no charge, only mass) to atoms of
mono-atomic system, influences on the LJ energy of whole system?
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