Re: [gmx-users] coupling issue

2013-05-16 Thread Justin Lemkul
On 5/16/13 8:12 AM, gromacs query wrote: Dear All, I have a system with two solutes (A and B) with water and ions. For pressure coupling in index file I defined two groups: Solute and Solvent, where solute consists of A+B and solvent consists of water+ions Due to some reasons I need to apply

[gmx-users] coupling issue

2013-05-16 Thread gromacs query
Dear All, I have a system with two solutes (A and B) with water and ions. For pressure coupling in index file I defined two groups: Solute and Solvent, where solute consists of A+B and solvent consists of water+ions Due to some reasons I need to apply position restraints on Solute A only for few