[gmx-users] delete molecule with command line?

Albert mailmd2011 at gmail.com
Wed Aug 20 11:28:52 CEST 2014


I am just wondering is it possible to delet water molecules within 4A of 
a ligand  through Gromacs command line? Everytime I have to do this in 
VMD which is a little bit complecated.....

thank you very much.

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