PyAutoFEP icon indicating copy to clipboard operation
PyAutoFEP copied to clipboard

Error in command 'prepare_dual_topology.py'

Open gsaha322 opened this issue 1 year ago • 1 comments

github_issue I am facing this issue after using the command prepare_dual_topology.py. Please clarify the issue.

gsaha322 avatar Nov 21 '23 13:11 gsaha322

check your gromacs using which gmx and which gmx_mpi

AzraelXu avatar Feb 01 '24 07:02 AzraelXu