subject:"\[gmx\-users\] MARTINI MD\-CG"

Re: [gmx-users] MARTINI MD-CG

2012-12-18 Thread Kieu Thu Nguyen

Thank Justin ! On Tue, Dec 18, 2012 at 10:31 PM, Justin Lemkul wrote: > > > On 12/18/12 10:30 AM, Kieu Thu Nguyen wrote: > >> Dear All, >> >> Are there any difference in nvt.mdp and npt.mdp files between MD-CG and >> MD-AA ? >> >> > Settings in the .mdp file are dictated by the chosen force fie

Re: [gmx-users] MARTINI MD-CG

2012-12-18 Thread Justin Lemkul

On 12/18/12 10:30 AM, Kieu Thu Nguyen wrote: Dear All, Are there any difference in nvt.mdp and npt.mdp files between MD-CG and MD-AA ? Settings in the .mdp file are dictated by the chosen force field. Every force field is different and requires proper settings. -Justin -- =