[gmx-users] Buckingham Potentials and oplsaa

ANAND AMITKUMAR DHARIA adharia at berkeley.edu
Fri Mar 25 10:42:07 CET 2016

Hi all,

Thanks for the advice in advance. I want to simulate a titania nanotube
with a biomolecule using parameters described previously by Matsui-Akaogi
(1991) for titania. How do I add parameters for the buckingham potential
for my titanium and oxygen atoms?


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