Dear Amber users,
I have a solvated system and I want to change the protein hydrogen atoms to
deuterium by just doubling their masses. I have edited the topology file of
the hydrogenated system and doubled the mass of the protein hydrogens under
%FLAG MASS
When I use this new topology file, will sander treat the protein hydrogens
as particles having double mass than the water hydrogens?
Jose M. Borreguero
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Received on Tue Feb 02 2010 - 12:30:04 PST
