Jürgen Bajorath

123PUBLICATIONS
63CO-AUTHORS
Modelling and simulationNeural networksProteins and peptidesDeep learningClinical pharmacology and therapeutics
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Publications (123)

|Jul 03, 2026
Commentary on the fundamentals and development of artificial intelligence models in the life sciences and best research practices.

|Jun 29, 2026
Explainable artificial intelligence reveals divergent learning in pharmacophore-based hierarchical pooling graph neural networks.

|Mar 04, 2026
Categorization of Protein Kinases by Combining Data from Cell Biology and Medicinal Chemistry Enables Further Evaluation and Differentiation of the Understudied Kinome.

Elena Kullmann, Selina Koch, Jürgen Bajorath

|Jan 14, 2026
Explainable artificial intelligence for molecular design in pharmaceutical research.

Alec Lamens, Jürgen Bajorath

|Jan 08, 2026
Transformer Learning in Sequence-Based Drug Design Depends on Compound Memorization and Similarity of Sequence-Compound Pairs.

Jürgen Bajorath

|Jun 13, 2025
Identifying and evaluating understudied protein kinases using biological and chemical criteria.

Selina Koch, Jürgen Bajorath

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Frequent Collaborators

5 joint publications

Martin Vogt

4 joint publications

Stefan Laufer

4 joint publications

José L Medina-Franco

4 joint publications

Filip Miljković