[gmx-users] AMBER99 P450 heme topology

Parker de Waal Parker.deWaal09 at kzoo.edu
Mon May 27 03:36:53 CEST 2013

Hi Everyone,

I've been looking running MD simulations on heme containing P450s using the
AMBER99 force field however have bee having a hard time generating or
finding a usable topology file for the heme cofactor.

Does anyone have any recommendations for heme topology files and how to use


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