Hi Gromacs users, I'm doing protein-Bilayer MD simulations. Enzyme contains structural zinc and calcium ions during Energy minimization, NVT and NPT stage, ions are changing there position even though I applied position restraints for the atoms and ions.
Anyone could help me out. Thanks -- View this message in context: http://gromacs.5086.x6.nabble.com/Change-in-the-positon-of-structural-Zinc-and-calcium-ions-during-MD-tp5012467.html Sent from the GROMACS Users Forum mailing list archive at Nabble.com. -- gmx-users mailing list firstname.lastname@example.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