[gmx-users] ligand_protein binding free energy caculation using gromacs

#ZHANG HAIPING# HZHANG020 at e.ntu.edu.sg
Sat Jun 7 12:25:47 CEST 2014

Dear gromacs user:

Can I used gromacs to calculate the binding free energy of ligand_protein complexes?  Is there any relevant tutorial or paper? Thanks a lot.

best regards,

Haiping Zhang

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