[gmx-users] Running Lyz in water

2011-06-29 Thread Ravi Kumar Venkatraman
Dear all, I have been running lyz in water. I have 20 ps pre-equilibrated NVT and 200 ps NPT configuration of spce216 water. I am following the instruction from gromacs tutorial. This is the link for the tutorial,

Re: [gmx-users] Running Lyz in water

2011-06-29 Thread Mark Abraham
On 06/29/2011 04:18 PM, Ravi Kumar Venkatraman wrote: Dear all, I have been running lyz in water. I have 20 ps pre-equilibrated NVT and 200 ps NPT configuration of spce216 water. I am following the instruction from gromacs tutorial. This is the link for the tutorial,