Implemetation of polarizability in GROMACS

GROMACS version: 2018.3
GROMACS modification: No
Does GROMACS enable simulations using polarizable FFs? If so, then how to use it?
Any help will be appreciated. Thanks in advance.


Hi Dhrubajyoti,

Currently, GROMACS does not support force-fields like amoeba, however it can emulate polarisability with Drude oscilators - find some documentation here: