subject:"\[gmx\-users\] g_hbond frames"

Re: [gmx-users] g_hbond frames

2011-10-16 Thread Justin A. Lemkul

Yao Yao wrote: Hi Gmxers, I ran g_hbond between my protein and water for a 3ns trajectory with 2 fs integration step but found the error, "Cannot calculate autocorrelation of life times with less than two frames", I am quite sure my system is just a regular protein in a cubic water box. An

[gmx-users] g_hbond frames

2011-10-16 Thread Yao Yao

Hi Gmxers, I ran g_hbond between my protein and water for a 3ns trajectory with 2 fs integration step but found the error, "Cannot calculate autocorrelation of life times with less than two frames", I am quite sure my system is just a regular protein in a cubic water box. And the size of traj