deisy yurley rodriguez sarmiento wrote:
Hi everyone,

I want to calculate the RMSD, and a few minutes to start the calculation, appears that Fatal Error:
calloc for bond_mat[i] (nelem=50001, elsize=4, file gmx_rms.c, line 650)

I don't have any idea what is the problem.

Sounds like a memory allocation problem.

http://www.gromacs.org/Documentation/Errors#Cannot_allocate_memory

If you want advice for troubleshooting, provide your command line, groups chosen for analysis, description of the system, etc.

-Justin


Thanks in advance!!!...

Deisy Y. Rodriguez S.
Practicante de Computos Avanzados
Grupo de Investigacion en Fisicoquimica Teorica y Experimental GIFTEX
Tel. 6344000  ext. 2792
Universidad Industrial de Santander



--
========================================

Justin A. Lemkul
Ph.D. Candidate
ICTAS Doctoral Scholar
MILES-IGERT Trainee
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080
http://www.bevanlab.biochem.vt.edu/Pages/Personal/justin

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