[gmx-users] Different models of TMAO
cy16f01.dilip at nitk.edu.in
Wed Mar 20 16:24:44 CET 2019
I have run a simulation with TMAO using Charmm36 FF and i want to see
whether different models of TMAO ie., Kast, Netz and Garcia models do
solvate/behave in the same way.
So, can anybody share the relevant parameter files as .rtp, .itp etc., of
the above mentioned three different TMAO models required to run the
How can i include the epsilon and LJ parameters in it...?
Any suggestions are appreciated.
With Best Regards,
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