[gmx-users] Using two integrators in energy minimization

I want to use both steepest descent and conjugate gradient in my energy minimization. I need the system to use steepest descent for a given number of steps and then switch over to conjugate gradient. Can anyone please suggest how I can do this? How should I make the em.mdp file Thanks in

Re: [gmx-users] Using two integrators in energy minimization

On Wed, Apr 3, 2013 at 11:07 AM, Abhinav Agrawal abhv.a...@gmail.comwrote: I want to use both steepest descent and conjugate gradient in my energy minimization. I need the system to use steepest descent for a given number of steps and then switch over to conjugate gradient. Can anyone please