[gmx-users] Different RMSD of the same system

2009-07-13 Thread Dechang Li
Dear all, I have did a simulation with explict water model using Gromacs-3.3.3. To save the hard disk space, I didn't collect the coordinates of water by using the following parameters: dt = 0.002 ; ps ! nsteps = 3000 ; total time. nstcomm

Re: [gmx-users] Different RMSD of the same system

2009-07-13 Thread Tsjerk Wassenaar
Hi Dechang Li, If your simulations are different, the results will be different. It's chaos! Cheers, Tsjerk 2009/7/13 Dechang Li li.d...@gmail.com: Dear all,        I have did a simulation with explict water model using Gromacs-3.3.3. To save the hard disk space, I didn't collect the