AW: AW: AW: AW: AW: AW: AW: AW: [gmx-users] g_current

2013-03-07 Thread Florian Dommert
ff: Re: AW: AW: AW: AW: AW: AW: AW: [gmx-users] g_current > > Hello, > > I run a 500ps simulation and save the trajectory each 3fs. > > g_current work till 498ps and later it shows -nan. > > Can you tell where is the problem > > Nilesh > > > > Hi, >

Re: AW: AW: AW: AW: AW: AW: AW: [gmx-users] g_current

2013-03-06 Thread Nilesh Dhumal
Ursprüngliche Nachricht- >> Von: gmx-users-boun...@gromacs.org [mailto:gmx-users- >> boun...@gromacs.org] Im Auftrag von Florian Dommert >> Gesendet: Mittwoch, 27. Februar 2013 18:46 >> An: 'Discussion list for GROMACS users' >> Betreff: AW: AW: AW: AW: AW: AW:

Re: AW: AW: AW: AW: AW: AW: AW: [gmx-users] g_current

2013-03-02 Thread Nilesh Dhumal
Ursprüngliche Nachricht- >> Von: gmx-users-boun...@gromacs.org [mailto:gmx-users- >> boun...@gromacs.org] Im Auftrag von Florian Dommert >> Gesendet: Mittwoch, 27. Februar 2013 18:46 >> An: 'Discussion list for GROMACS users' >> Betreff: AW: AW: AW: AW: AW: AW:

AW: AW: AW: AW: AW: AW: AW: [gmx-users] g_current

2013-03-01 Thread Florian Dommert
An: 'Discussion list for GROMACS users' > Betreff: AW: AW: AW: AW: AW: AW: AW: [gmx-users] g_current > > > -Ursprüngliche Nachricht- > > Von: gmx-users-boun...@gromacs.org [mailto:gmx-users- > > boun...@gromacs.org] Im Auftrag von Nilesh Dhumal > > G

AW: AW: AW: AW: AW: AW: AW: [gmx-users] g_current

2013-02-27 Thread Florian Dommert
> -Ursprüngliche Nachricht- > Von: gmx-users-boun...@gromacs.org [mailto:gmx-users- > boun...@gromacs.org] Im Auftrag von Nilesh Dhumal > Gesendet: Mittwoch, 27. Februar 2013 17:38 > An: Discussion list for GROMACS users > Betreff: Re: AW: AW: AW: AW: AW: AW: [gm

Re: AW: AW: AW: AW: AW: AW: [gmx-users] g_current

2013-02-27 Thread Nilesh Dhumal
gt;> boun...@gromacs.org] Im Auftrag von Nilesh Dhumal >> Gesendet: Mittwoch, 27. Februar 2013 15:26 >> An: Discussion list for GROMACS users >> Betreff: Re: AW: AW: AW: AW: AW: [gmx-users] g_current >> >> Hello, >> >> Yes. Segfault is solved. I saving vel

AW: AW: AW: AW: AW: AW: [gmx-users] g_current

2013-02-27 Thread Florian Dommert
Mittwoch, 27. Februar 2013 15:26 > An: Discussion list for GROMACS users > Betreff: Re: AW: AW: AW: AW: AW: [gmx-users] g_current > > Hello, > > Yes. Segfault is solved. I saving velocites and coordinates at 2 ps. > > Nilesh > > > Hi, > > > > At leas

Re: AW: AW: AW: AW: AW: [gmx-users] g_current

2013-02-27 Thread Nilesh Dhumal
Hello, Yes. Segfault is solved. I saving velocites and coordinates at 2 ps. Nilesh > Hi, > > At least the segfault is solved. However, the zero output of M_J for your > IL system is really strange. I'm thinking about a reason, but I am > currently > not able to find one. How often do you write

AW: AW: AW: AW: AW: [gmx-users] g_current

2013-02-27 Thread Florian Dommert
Hi, At least the segfault is solved. However, the zero output of M_J for your IL system is really strange. I'm thinking about a reason, but I am currently not able to find one. How often do you write out velocities and coordinates in your trr file? /Flo > -Ursprüngliche Nachricht- > Von