[gmx-users] Modulation of protein water intermolecular interactions

[Sudipta Sinha]

Hi All,

How can I modulate only the protein water interaction in gromacs. I just
want to increase or decrease only the intermolecular interaction (i,e
scaling of interaction strength) between the water and protein and perform
the equilibrium MD simulation at reduced or increased  interaction strength.

Best
Sudipta