[gmx-users] Cannot find position restraint file
Neena Susan Eappen
neena.susaneappen at mail.utoronto.ca
Sun Mar 24 04:39:07 CET 2019
Hello gromacs users,
For the equilibration phase 1, an error message came up following this command:
gmx grompp -f nvt.mdp -c em.gro -p topol.top -o nvt.tpr
Error: Cannot find position restraint file restraint.gro (option -r)
I do not have a posre.gro file, only posre.itp file. I don't understand this, any insight would be appreciated.
Thank you,
Neena
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