[gmx-users] Error in PDB2GMX

sunny mishra mishra.sunny at gmail.com
Fri Aug 7 01:35:19 CEST 2009

Hi Justin,

Thanks for the expedient reply. I referred MARTINI but after
converting 1A8G.pdb to 1A8G_CG.pdb i.e. CG structure of protein I dnt
know how to make the topol.top and conf.gro files for that and also I
am not able to generate the posre.itp file with this CG structure
because it says the fatal error : Incomplete ring of HIS 69. So I
don't know how to proceed now and do my simulations.



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