[gmx-users] adding parameters for selenium ion

Meenakshi Rajput ashi.rajput39 at gmail.com
Thu Mar 5 07:19:16 CET 2015


hello gromacs users
I need to add selenium ion in the cysteine residue in place of sulphur in
the protein complex simulation. I am using Charmm27 force field. Can
anybody tell me the procedure of adding parameters for selenium ion
specific for the force field?? and from where I can get these parameters..??


More information about the gromacs.org_gmx-users mailing list