Dr. Simmerling,
For the Trp-cage study you mentioned (or otherwise), did you
compare energy of your minimum energy conformation with
those of NMR structures?
I am using parm99 with your corrections and still certain
conformations have PE lower than NMR structures. I am
wondering if I made a mistake while including your
corrections.
Thanks,
Pratul
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Received on Thu Aug 07 2003 - 19:53:01 PDT
