[gmx-users] Fatal error: Rerun .trr trajectory

Hassan Aaryapour hassan.gromacs at gmail.com
Sat Jun 30 16:23:39 CEST 2018

Dear Gromacs Users
When I rerun .trr trajectory files for re-calculating energies and forces,
the following error was received. Any suggestion to solve it please?

Command line: gmx mdrun -v -s md.tpr -rerun md.trr
Program:     gmx mdrun, version 2018
Source file: src/programs/mdrun/md.cpp (line 884)
Fatal error: Rerun trajectory frame step 100000000 time 200000.000000 does
not contain a box, while pbc is used.


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