How to prevent the aggregation of ligands?

rainbow · October 1, 2021, 1:58pm

GROMACS version:2021.2
GROMACS modification: No

Hello,
When simulating a system with proteins and high concentrations of free ligands, is there any way to confer a repulsive potential to prevent aggregation of each of these ligands?

Kind regards,

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How to prevent the aggregation of ligands?

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