hello gromacs users i am working on protein ligand complex with popc membrane i want to calculate the free energy of protein and ligand i have to follow which tutorial (methane in water) but my protein is membrane protein i am also running md simulation (70 ns) i am new in free energy calculation from where i have to start after the production md or i can start from the original pdb file kindly help -- Gromacs Users mailing list
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