[gmx-users] Re: Loss of bonds in HEME iron after pdb2gmx

Justin A. Lemkul jalemkul at vt.edu
Wed Nov 26 13:25:07 CET 2008

Justin A. Lemkul wrote:

> S and Fe atoms to be 0.25 +/- 0.2 nm apart.  If they are much further 

Edit that: 0.25 nm +/- 0.02 nm.  Apparently my math (and/or typing) skills are 
suspect first thing in the morning :)



Justin A. Lemkul
Graduate Research Assistant
Department of Biochemistry
Virginia Tech
Blacksburg, VA
jalemkul[at]vt.edu | (540) 231-9080


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