[gmx-users] pi pi stacking interaction

Netaly Khazanov netalyk at gmail.com
Wed Jun 10 10:13:13 CEST 2015


Hi all,

I want to find out a way to follow pi pi stacking interactions between
ligand/protein during MD simulation.
Is there any script/plugin that can analyse the trajectory in term of
proper geometry position or maybe in term of energy?
What is best way to do it?

Thanks in advance

Netaly Khazanov





-- 
Netaly


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