[gmx-users] tpbconv

Nguyen Hoang Phuong phuong at theochem.uni-frankfurt.de
Sat Jul 27 17:40:21 CEST 2002

Dear All,

I use the program tpbconv to remove the solvent from my tpr file and rerun
the simulation without solvent. The simualtion is crashed with the error:

Fatal error: calloc for theta[i] (nelem=-21307068, elsize=8, file pme.c,
line 699): Cannot allocate memory

Can anyone tell me what is wrong here? Thanks in advance.



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