[gmx-users] Strange error
r.k.badhan at stud.man.ac.uk
Sat Nov 29 08:21:02 CET 2003
In reply to my own posting, I came across this error whilst solvating
a protein box containing solvent and 2 ligand:
Fatal error: realloc for nl->iinr (40509752 bytes, file
src\mdlib\ns.c, line 97, nl->iinr=0x0x 0): No such file or
However, I tried this without the ligands and it worked fine, I was
able to solvate the box. But with the ligands (ATP) this error
LIgands were added via Drug-Enzyme tutorial.
And it seems the program tried to access over 2.5 GB worth of
memory before it halts.
Any ideas why?
School of Pharmacy and Pharmacetical Science
The University of Manchester
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