[gmx-users] Constant-Force Pulling of Ubiquitin

Hi GMX Users, I am using Gromacs (Version 4.5.5) to do constant-force pulling of ubiquitin and it's a implicit model. My mdp file for pulling is shown as following. integrator = md dt = 0.001; ps ! nsteps = 50 ; total 500 ps. nstxout

[gmx-users] Constant-Force Pulling of Ubiquitin

Hi GMX Users, I am using Gromacs (Version 4.5.5) to do constant-force pulling of ubiquitin and it's a implicit model. My mdp file for pulling is shown as following. integrator = md dt = 0.001; ps ! nsteps = 50 ; total 500 ps. nstxout

Re: [gmx-users] Constant-Force Pulling of Ubiquitin

You want to switch to sd instead of md. On Oct 29, 2013, at 17:43, Vivian ww...@bu.edu wrote: Hi GMX Users, I am using Gromacs (Version 4.5.5) to do constant-force pulling of ubiquitin and it's a implicit model. My mdp file for pulling is shown as following. integrator =

Aw: Re: [gmx-users] Constant-Force Pulling of Ubiquitin

An:Discussion list for GROMACS users gmx-users@gromacs.org Betreff:Re: [gmx-users] Constant-Force Pulling of Ubiquitin You want to switch to sd instead of md. On Oct 29, 2013, at 17:43, Vivian ww...@bu.edu wrote: Hi GMX Users, I am using Gromacs (Version 4.5.5) to do constant-force pulling