Re: [gmx-users] questions about steer molecular dynamics by using gromacs4

mirc...@sjtu.edu.cn wrote: Dear All: I am trying to use steer molecular dynamics simulations to pull a ligand along a channel pore (along the Z axis) by constant rate. I know how to realize this by GROMACS3, however, it seemed that in gromacs4, there are some changes regarding this issues,

[gmx-users] questions about steer molecular dynamics by using gromacs4

Dear All: I am trying to use steer molecular dynamics simulations to pull a ligand along a channel pore (along the Z axis) by constant rate. I know how to realize this by GROMACS3, however, it seemed that in gromacs4, there are some changes regarding this issues, so I am pasting my pull c