subject:"\[gmx\-users\] POSITION RESTRAIN ERROR"

Re: [gmx-users] POSITION RESTRAIN ERROR

2013-09-25 Thread Justin Lemkul

On 9/25/13 6:05 AM, MUSYOKA THOMMAS wrote: Dear Users, I am running Protein-Ligand MD simulations. Whenever, i get to do the Position restrain run of both my protein and ligand, i get this error; Making 1D domain decomposition 4 x 1 x 1 starting mdrun 'Protein in water' 5 steps,100.0 ps

[gmx-users] POSITION RESTRAIN ERROR

2013-09-25 Thread MUSYOKA THOMMAS

Dear Users, I am running Protein-Ligand MD simulations. Whenever, i get to do the Position restrain run of both my protein and ligand, i get this error; Making 1D domain decomposition 4 x 1 x 1 starting mdrun 'Protein in water' 5 steps,100.0 ps. step 0 Step 8, time 0.016 (ps) LINCS WARNING