[gmx-users] how to select heavy atoms of Ligand

atsutoshi.okabe at takeda.com atsutoshi.okabe at takeda.com
Tue May 20 14:14:30 CEST 2014

Dear all,

I would like to make index file of heavy atoms of ligand by g_select command.
However, I don't know how to select heavy atoms of ligand.
I tried g_select -select "resname LIG and not name H" command, but it did not work.
Could you tell me any advice?

Atsutoshi Okabe

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