which force field should I choose for protein-ligand interaction simulation and how to set mdp file in GROMACS?
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2.7 years ago
aminijavad4 ▴ 10

Hi,

I am a beginner in GROMACS, I want to simulate Protein-ligand interaction but I don't know which force field should I choose and how to set mdp file. There is lots of option and I'm confused.

Thanks for your help.

GROMACS • 366 views
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