[gmx-users] mdrun error

Rahul Karyappa r.karyappa at ncl.res.in
Mon Dec 5 15:07:02 CET 2005


Dear all,

    I am running the test simulation on my model. I
started the MD simulation for 500 steps but after 100 steps it gave me
following error:


Fatal error: ci = -2147483648 should be in 0 .. 674 [FILE nsgrid.c, LINE 218]


I know this error comes because of larger forces. For that I have
minimized my structure but still it gives me this error. How should I
proceed now? WAiting for your kind reply.


Rahul Karyappa




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