[gmx-users] tpbconv

[Nguyen Hoang Phuong]

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.

Regards,

Phuong