On 28/04/15 10:41, Lau Sze Yi (SIgN) wrote:
Hi,
I fitted small molecule ligand into observed electron density using
the Find Ligands function and did a density fit analysis. What is
considered an acceptable score?
You want a density correlation of greater than 0.89 to be better than
the m
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Dear Sze Yi,
I think Rupp-validation might be more helpful than a score cut-off in
your case:
Would you take a drug developed based on how the ligand fits the
density you are observing?
Best,
Tim
On 04/28/2015 11:41 AM, Lau Sze Yi (SIgN) wrote:
> H
