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David Koes edited subsection_HIV_RT_Virtual_screening__.tex
over 8 years ago
Commit id: c64d1cce0c27dee982159595a8b82cb83e53b7bf
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\subsection*{HIV-RT} \subsection*{HIV Reverse Transcriptase}
Virtual screening results for HIV reverse transcriptase (HIV-RT) are shown in Figure~\ref{hivrt}. Again, the only method to outperform random selection is RDKit with an AUC of 0.57. However, FOMS displays the best early enrichment up to a true positive rate of 17\% and the shape constraint queries are statistically significant and can identify enriched subsets with the same proficiency as RDKit shape similarity.
%include ip figure?