[AMBER] crash due to ewald

From: Jorgen Simonsen <jorgen589.gmail.com>
Date: Fri, 21 Oct 2011 14:17:42 +0200

Hi all

I try to restart my simulation - I have been able to continue the
simulation by restarting every 20 ns but after 80 ns I get a restart
file which gives me the following error when I try to run it again

At line 2773 of file _ew_setup.f
Fortran runtime error: Bad value during floating point read
--------------------------------------------------------------------------
mpirun has exited due to process rank 0 with PID 19782 on
node s67p24 exiting without calling "finalize". This may
have caused other processes in the application to be
terminated by signals sent by mpirun (as reported here).
--------------------------------------------------------------------------

I have check the simulation and I cannot see any obvious errors during
the simulation. How to resolve or debug to find the error - any
suggestions highly appreciated

Thanks

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Received on Fri Oct 21 2011 - 05:30:03 PDT
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