[gmx-users] How to exit cluster during the simulation

Batdorj Batsaikhan batsaikhanbat at yahoo.com
Sun Jun 15 06:53:19 CEST 2014

Thank you. 

Also how to know cpu performance and resting time of simulation after exit.

On Sunday, June 15, 2014 12:45 PM, 陈功 <gchen511 at gmail.com> wrote:

Seems like :  nohup mpirun -np 8 mdrun_mpi -v -deffnm your_tpr >output.info &


>From: Batdorj Batsaikhan
>Date: 2014-06-15 11:53
>To: gromacs.org_gmx-users at maillist.sys.kth.se
>Subject: [gmx-users] How to exit cluster during the simulation
>Dear GMX users,
>I am a new user of gromacs on cluster. I use putty to connect to the cluster. I have a problem. How to exit cluster during the simulation?
>My last command is " mpirun -np 8 mdrun_mpi ... " 
>in the past,  I clicked "X" button of putty, mdrun did not finished. 
>Thank you.
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