[gmx-users] Distance Restraints set for water-ion cluster in gas phase (vacuum)

Dear gromacs usres, I want to run nvt simulation of water-ion cluster (Na+(H2O)250) in gas phase (vacuum) at higher temperature ( bigger than 200 K). But the cluster will collapse at high temperature. So the distance restraints is used to restraint the water molecules and the ion Na+ not to

Re: [gmx-users] Distance Restraints set for water-ion cluster in gas phase (vacuum)

On 10/13/14 4:48 AM, liuyong_1...@dicp.ac.cn wrote: Dear gromacs usres, I want to run nvt simulation of water-ion cluster (Na+(H2O)250) in gas phase (vacuum) at higher temperature ( bigger than 200 K). But the cluster will collapse at high temperature. So the distance restraints is used to