[gmx-users] HEME-LIGAND

Anthony Cruz acb15885 at uprm.edu
Wed Jan 25 22:13:57 CET 2006

I want to run a simulation of heme - ligand complex of hemoglobin. How I could 
set up the Fe-ligan bond?? The parameters for some ligands ej CO, O2, CN.. 
exist in gromacs??? How I could get it???

Best regards,

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