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PXR-Modeling

Overview

PXR-Modeling is a machine learning project predicting Pregnane X Receptor (PXR) activity. Developed as part of the OpenADMET challenge.

Structure Challenge Visualizations

Boltz2 no-MSA vs MSA structure comparison

ESMFold2 best-of-25 structure dashboard

Phases

PhaseDescriptionStatus
Phase 1 Post-MortemActivity predictionComplete
Phase 2 Activity Final ReportActivity prediction final reportComplete
Structure Challenge Model ReportAccepted structure model provenanceComplete