Thanks Mark.
--
Sonali Dhindwal
--- On Fri, 13/8/10, Mark Abraham wrote:
From: Mark Abraham
Subject: Re: [gmx-users] Restarting the job
To: "Discussion list for GROMACS users"
Date: Friday, 13 August, 2010, 8:46 AM
- Original Message -
From: sonali dhindwal
Date: Friday,
- Original Message -
From: sonali dhindwal
Date: Friday, August 13, 2010 0:59
Subject: [gmx-users] Restarting the job
To: Discussion list for GROMACS users
---
| ---
| > He
Hello All,
I have a query regarding the restarts of the jobs after crash.
I want to simulate a protein for 2 ns but in between due to system shutdown, it
stopped, and I made a restart using this command:
mdrun -s topol.tpr -cpi state.cpt -appendnow I checked the rmsd of in between
by producing a
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