[gmx-users] megnesium -heme

Lakshmi Padmavathi lpulagam at uos.de
Fri Nov 14 19:38:01 CET 2003

Dear gromacs users,
     you helped me many times , thank you very much for all of you.

i am doing simulation with a chlorophyll.
i took the parameters from the heme forcefield of ffG43b1.
is it correct?

how can i choose the parameters for the bond lenth and angle of megnisium 
instead of Iron.
for example.
N - Mg

thank you very much



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