[gmx-users] protonated cys -S

Giacomo Bastianelli gbastian at pasteur.fr
Fri Nov 10 11:11:02 CET 2006

Dear users,

I have just found that gromacs protonate the -S of
my Cys and I would like to have it deprotonated
to form a disulphide bond (It is present in the original
pdb file).

Is there any way I can modify it?

thanks in advance,


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