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Junior Member
Scoring Functions
Howard,
Just a quick question about the scoring function. I noticed on the results section the lowest energy and smallest rotational gyration scores were quite a bit off from the smallest RMSD.
What (if you are in a position to disclose at this point) optimizations have you put into the current scoring functions based on the results from Phase Ia? (too soon for feedback from Ib I'm sure)
Just curious.
Dan
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