[gmx-users] error in linux rpm
Wolfgang Zocher
WZocher at t-online.de
Thu Apr 25 22:58:59 CEST 2002
Hi all,
I downloaded gromacs-3.1.3-1.i386.rpm this afternoon. But running the
demo results in an error in mdrun_em-step:
Getting Loaded...
Reading file cpeptide_em.tpr, VERSION 3.1.3 (single precision)
Reading file cpeptide_em.tpr, VERSION 3.1.3 (single precision)
Loaded with Money
Steepest Descents:
Tolerance = 1.00000e+03
Number of steps = 100
Step= 0, Dmax= 1.0e-02 nm, Epot= 3.40282e+38 Fmax= inf, atom= 1
Fatal error: ci = -2147483616 should be in 0 .. 95 [FILE nsgrid.c, LINE 210]
What is wrong in the rpm??
Thanks to all,
Wolfgang Zocher
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