GROMACS version:2020.4-MODIFIED
GROMACS modification: Yes/No
Hey everyone, I am a newbee for Gromacs. I am trying to run the simulation for my polymer. I am planning to solvate it after I am successful running the simulation with only the polymer in the box. I prepared the file and run the minimization, equilibration, and production. But it fails and the slurm file said :Assertion failed:
Condition: realGrid_
Bad (null) input real-space grid
I am wondering what’s going with my file. The attached file all my input file for the simulation. Any help would be appreciated! Thanks ahead!!
PPLn_question