How to solve the GROMACS error: The initial cell size (0.657461) is smaller than the cell size limit (0.683200)?

I am simulating a glycerol-water mixture system in a square box of length 3.5 nm. After the NPT step my box size decreased to 2.62984 nm. However, in the beginning of the production run step I...

28 February 2020 2,993 1 View