Hi, Amber lovers:
After I did long time dynamics simulation using sander, I want to know the
features on the same protease but one mutated residue on it. Is there a
simple way to get the features without doing another dynamics simulation?
(It took me about 2 months)
A related issue: If I perform MD simulation on two or more proteases all of
which are obtained by a single mutation from the original one, is there a
simple way to do that? For what I want to know is the movement of backbone,
I think CMC/MD is not the right program I want. Any suggestion and reply is
helpful for me. Thanks.
William.
Received on Thu May 16 2002 - 16:11:36 PDT
