I'm trying to generate opls-aa topology for cellulose chain. Using LigParGen executable installed on my local computer, I get the following error. It's so confusing for me, because using Ligpargen website the topology is generated easily for me.
I appreciate your helps very much
Issue Information
I'm trying to generate opls-aa topology for cellulose chain. Using LigParGen executable installed on my local computer, I get the following error. It's so confusing for me, because using Ligpargen website the topology is generated easily for me. I appreciate your helps very much
KeyError: 'ANGfinal'
Expected Behavior
I expected topology generation
Actual Behavior
cellulose.txt