[gmx-developers] smalloc.c

[Patricia Soto Becerra]

Hi,
I want to implement the rest algorithm (PNAS, 102, 39, 13749-13754. 
(2005)). I have been following the discussions in the list of a very 
similar implementation, particularly:

http://www.gromacs.org/pipermail/gmx-developers/2006-January/001493.html
http://www.gromacs.org/pipermail/gmx-developers/2006-January/001494.html

Nevertheless, I get the error message:
______________________________________
Source code file: smalloc.c, line: 113
Fatal error:
calloc for ir->opts.nrdf (nelem=1066665789, elsize=4, file tpxio.c, line 
487)
-------------------------------------------------------

I just cannot figure it out... Does anybody have a suggestion on how to 
solve this?

Thanks!

Patricia

~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_~_
~_ Dr. Patricia Soto
~_ Post-doctoral Researcher
~_ Department of Chemistry and Biochemistry
~_ University of California, Santa Barbara CA 93106 - 9510 
~_ United States
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