[gmx-users] PROTEIN FOLDING
nehaphysics17 at gmail.com
Tue Dec 19 08:06:29 CET 2017
Hi gromacs users,
After MD simulation of protein-ligand complex for 5ns, can we view protein
How to do it?
I want to ascertain if there is any conformation change in protein where
the ligand binds. Is it possible?
We observe hydrogen bonds through molecular docking. Hence, I want to make
observation through MD simulation which is not obtained through docking.
Can someone help me regarding this?
Thank you very much in advance.
More information about the gromacs.org_gmx-users