AMBER Archive (2000)

Subject: amber parameters request

From: Alexandre Gillet (gillet_at_glycine.jouy.inra.fr)
Date: Wed Jan 19 2000 - 13:37:34 CST


I would like to know where I can find Amber force field parameters

for a S-FE bond.

I need to run a simulation an the cytochrome P450 bm3 in which

a cystein is bond to the Fe of a haem.

Getting this information will help me a lot.

==========================================================================
Alexandre Gillet

graduate student
Mathematique Informatique et Genome,
Batiment des Biotechnologies, Email: gillet_at_glycine.jouy.inra.fr
INRA, Jouy-en-Josas, 78352, France