Dear All,
I want to carry out SMD on a protein-protein complex. When I read the
input file in the manual as well as on the mailing list, i find that
there are ways to define atoms using "iat" and the "igr" commands.
However, does anyone have experience in defining whole residues ?
thanks
regards
ayesha, UM
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Received on Wed Apr 08 2015 - 08:00:11 PDT
