[gmx-users] Getting ligand's topology

Mahdi Sobati Nezhad mahdisobatinezhad at gmail.com
Sat Aug 18 15:32:17 CEST 2018

I'm a begginer in taking ligand's topology from CGENFF and my '.str' file
have some high penalty numbers. What I can do?!
And how I can do validation and optimization?!
I read the FAQ in its server but I don't understand!!!

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