[gmx-users] Errors in Minimization using grompp

reisingere at rostlab.informatik.tu-muenchen.de reisingere at rostlab.informatik.tu-muenchen.de
Wed Jun 13 10:44:30 CEST 2012


Hi everybody,
I want to do a minimization of the hydrogens of my protein. Only the
hydrogens. And I want to do this with implicit solvent.
All the time when I try it there are errors in my .mdp file. Can you
please give me an example how such a .mdp file should look like.

Thank you,
Eva




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