Re: [gmx-users] EM comparison

Kushal Seth wrote: Hi all ! I was doing EM for a bilayer. While using the mdp file containing only the energy minimization terms my energy is minimized but i get the following : Converged to machine precision, but not to the requested precision Fmax < 100 Double precision normally gives you h

[gmx-users] EM comparison

Hi all ! I was doing EM for a bilayer. While using the mdp file containing only the energy minimization terms my energy is minimized but i get the following : Converged to machine precision, but not to the requested precision Fmax < 100 Double precision normally gives you higher accuracy. You m