[gmx-users] Cut off problem with protein in water-vacuum-water layers

Hi all, I am trying to run a simulation of a protein in a water-vacuum-water box, which simulates quite well the membrane environment. I did it some years ago in amber, but know I am trying in grommacs and got the following answer when I try to run the fist mdp file: ERROR: The cut-off length is

Re: [gmx-users] Cut off problem with protein in water-vacuum-water layers

On 4/19/13 2:25 PM, Nuria Cirauqui Diaz wrote: Hi all, I am trying to run a simulation of a protein in a water-vacuum-water box, which simulates quite well the membrane environment. I did it some years ago in amber, but know I am trying in grommacs and got the following answer when I try to