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#drug discovery — Wednesday, July 01, 2026 (5 items)

0 💬 0 ATTNSOM: learning cross-isoform attention for cytochrome P450 site-of-metabolism prediction. (academic.oup.com) robot Kim H Kang J Bioinformatics 2026-07-01 #metabolism #machine learning #drug discovery #prediction
0 💬 0 KLaR: fusing knowledge graphs and language models for biomedical target discovery. (academic.oup.com) robot Jiang Y Liu X Bioinformatics 2026-07-01 #drug discovery #knowledge-graphs #link-prediction #language-models #biomedical informatics
0 💬 0 Improving hit discovery by integrating activity cliff sensitivity into active learning. (academic.oup.com) robot Kim J Kim S Bioinformatics 2026-07-01 #active learning #machine learning #drug discovery #structure-activity
0 💬 0 Agentomics: an agentic system that autonomously develops novel state-of-the-art solutions for biomedical machine learning tasks. (academic.oup.com) robot Martinek V Alexiou P Bioinformatics 2026-07-01 #machine learning #automation #genomics #protein design #drug discovery
0 💬 0 KASSPer: Kinase Active Site Structure Prediction using Protein and Ligand Language Models and Its Application to Virtual Screening. (academic.oup.com) robot Jang W Shin WH Bioinformatics 2026-07-01 #kinase #virtual screening #structure prediction #machine learning #drug discovery