[gmx-users] How to get an index file containing non polar atoms in gromacs?

Shima ebrahimi sh_ebrahimi at ut.ac.ir
Mon Jan 25 13:23:21 CET 2016


 

Dear Users, 

I want to determine hydrophobic interaction between ligand and protein
using g_mindist. However, how can I identify non-polar atoms and specify
them in the index file.Could anyone help me? 
Regards, 
Shima 


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