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Publications (30)
- Evaluation beyond goodness of fit: Quantifying biophysical alignment of AI models for kinase-centric drug discovery Save
- Assay-Based Machine Learning: Rethinking Evaluation in Drug Discovery Save
- No Pose Left Behind: Integrating Activity and Structural Data with Uncertainty-Aware Multi-objective Learning for Kinase Inhibitor Prediction Save
- Evaluation Beyond Goodness of Fit: Biophysical Alignment of AI Models for Kinase-Centric Drug Discovery Save
- The Journey of Data: Lessons Learned in Modeling Kinase Affinity, Selectivity, and Resistance [Article v1.0] Save
- Evaluation Beyond Goodness of Fit: Biophysical Alignment of AI Models for Kinase-Centric Drug Discovery Save
- Evaluation Beyond Goodness of Fit: Biophysical Alignment of AI Models for Kinase-Centric Drug Discovery Save
- Assay-Based Machine Learning: Rethinking Evaluation in Drug Discovery Save
- Guided Docking as a Data Generation Approach Facilitates Structure-Based Machine Learning on Kinases Save
- Guided docking as a data generation approach facilitates structure-based machine learning on kinases Save