[gmx-users] Regarding mdrun

Venkat Reddy venkat4bt at gmail.com
Fri Jun 7 07:56:29 CEST 2013

Dear gmx-users,
I am experiencing some strange things while performing mdrun. I am running
a CG simulation and it is terminating with LINCS warnings after approx.
500ns of simulation. If I restart it with the check point file, then its
running with out any errors. Is my simulation is reliable?? I am using

Thank you

With Best Wishes
Venkat Reddy Chirasani
PhD student
Laboratory of Computational Biophysics
Department of Biotechnology
IIT Madras

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