Dear all,
I wanted to take a query about some results that I have obtained in my
molecular dynamics.
I have launched a dynamic of a protein-ligand complex (the ligand is a
tretasaccharide), and of the two domains that the pdb of my protein
initially presents, the disulfide bonds that form one of them ends up
breaking ... But the energy data endings are the same as in any other
dynamic that has been launched under the same conditions and with the
same complex ...
Has someone this or something similar happened to him?
any ideas?
Thanks in advance,
Myriam
_______________________________________________
AMBER mailing list
AMBER.ambermd.org
http://lists.ambermd.org/mailman/listinfo/amber
Received on Fri Nov 06 2020 - 03:00:02 PST
