Mar 25, 2009 � The MM-GB(PB)/SA method as well as the X-Score scoring function were applied to compute the binding affinities of these complexes. The structure�...
We have studied the binding affinities of a set of 45 small-molecule inhibitors to protein tyrosine phosphatase 1B (PTP1B) through computational approaches.
Mar 25, 2009 � The correlation coefficient between the MM-GB/SA results and experimental binding data was 0.87 and the standard deviation was 0.60 kcal/mol.
The X-Score scoring function was found to produce equally good results as MM-GB/SA on both the complex structures prepared by molecular docking and the�...
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Jun 26, 2023 � Bibliographic details on Interpretation of the Binding Affinities of PTP1B Inhibitors with the MM-GB/SA Method and the X-Score Scoring�...
Interpretation of the Binding Affinities of PTP1B Inhibitors with the MM-GB/SA Method and the X-Score Scoring Function. Article. Apr 2009. Xinglong Zhang�...
Interpretation of the Binding Affinities of PTP1B Inhibitors with the MM-GB/SA Method and the X-Score Scoring Function. Article. Apr 2009. Xinglong Zhang�...
5 days ago � Zhang, X., Li, X. & Wang, R. Interpretation of the binding affinities of PTP1B inhibitors with the MM-GB/SA method and the X-score scoring�...
Apr 25, 2023 � Overexpression of PTP1B enhances insulin resistance, but its depletion or inhibition negates insulin resistance, promotes insulin sensitivity,�...
Jun 13, 2021 � Interpretation of the Binding Affinities of PTP1B Inhibitors with the MM-GB/SA Method and the X-Score Scoring Function � Xing-long ZhangXun Li�...