[gmx-users] Value for bonded force constant (Kb)

[raja]

Hi gmxions, 
Based on the litterature search , I am going to use Kb
value of " 4 Kcal/mol A2" (1673.6 KJ/mol nm2)as harmonic bonded force
field constant(type 6) for restraining distance of Fe(II) ligated with
atoms of 2 Nitrogen  and  1 Oxygen. If any one having objection please
correct me ):  .


With thanks !
B.Nataraj
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  raja
  raja_28 at fastmail.us

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