On Sat, Nov 06, 2021, Ch Bilal wrote:
>
>I am performing system preparation of a protein-ligand complex (a protein
>of 1321aa) using AMBER20. The problem is that ligand gets broken during
>system preparation. I am attaching the system preparation commands
>here. Could you please help me to find out what is the problem?
Can you explain more about what you mean when you say "the ligand gets
broken"? Have you run a simulation with just the ligand, and no protein?
....dac
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Sat Nov 06 2021 - 06:30:03 PDT