Re: [gmx-users] protein domain separation

2009-10-18 Thread Justin A. Lemkul
ry time. -Justin Hope that helped, Vaclav --- On Sun, 10/18/09, hazizian wrote: From: hazizian Subject: [gmx-users] protein domain separation To: gmx-users@gromacs.org Date: Sunday, October 18, 2009, 7:38 AM Hi I have done md simulation of a 2-domain protein in water, in 50 K but every t

Re: [gmx-users] protein domain separation

2009-10-18 Thread Vaclav Horacek
lped, Vaclav --- On Sun, 10/18/09, hazizian wrote: > From: hazizian > Subject: [gmx-users] protein domain separation > To: gmx-users@gromacs.org > Date: Sunday, October 18, 2009, 7:38 AM > > Hi > I have done md simulation of a 2-domain protein in water, > in 50 K but every

[gmx-users] protein domain separation

2009-10-18 Thread hazizian
Hi I have done md simulation of a 2-domain protein in water, in 50 K but every time I did it these domains are separated from each other, and dont correct when I do trjconv -pbc nojump, previous time when I did em or pr by doing trjconv -pbc nojump, it corrected. The 50.mdp file is: title