Dear Gromacs Users,
I am working on a protein complex with two subunits which are
heterologous and I docked them using HADDOCK. Now, to one of the subunit
I built a ligand covalently attached to one of the residue, which enters
into the active site of the another subunit in the complex.
Now I want to simulate the entire complex i.e. the two subunits and the
bound ligand. Does anyone know how it can be done.
Many thanks
Rohit
PhD Biosciences
University of Birmingham
--
gmx-users mailing list gmx-users@gromacs.org
http://lists.gromacs.org/mailman/listinfo/gmx-users
Please search the archive at
http://www.gromacs.org/Support/Mailing_Lists/Search before posting!
Please don't post (un)subscribe requests to the list. Use the
www interface or send it to gmx-users-requ...@gromacs.org.
Can't post? Read http://www.gromacs.org/Support/Mailing_Lists