Hengwei Chen
Research Investigator - AIDD @ BeiGene
About
Dr. rer. nat. (PhD, Grade 0.7 – Magna cum laude) in Computational Life Science from the University of Bonn under the supervision of Prof. Dr. Jürgen Bajorath, affiliated with the Bonn-Aachen International Center for Information Technology & Lamarr Institute for Machine Learning and Artificial Intelligence. Currently working at BeOne Medicines (BeiGene) as an AIDD Research Investigator. With over five years of research experience and 12 peer-reviewed publications in AI-driven computational drug design and cheminformatics, my expertise centers on generative molecular design using advanced machine/deep learning technologies and chemical/biochemical language models. Applications include medicinal chemistry tasks such as predicting activity cliffs and highly potent compounds, target-specific molecule generation, and analogue series expansion toward higher potency. In addition to academic research, I bring one year of industrial experience developing an AI-driven platform for molecular bioactivity and ADMET prediction, collaborating with cross-functional R&D teams, and applying generative AI to 3D pocket-based molecular design. I am dedicated to leveraging my combined academic and industrial expertise in AI and life sciences to accelerate innovation in drug discovery.
Germany
Bonn
Pharmaceuticals
Machine Learning, Deep Learning, Drug Discovery, AI computational chemistry, Large Language Models (LLM), Cheminformatics, Model Development, AI Computational Medicinal Chemistry, Molecular Generation, Generative AI, Chemical Language Model, Transformer, Predictive AI, Protein Language Model, BERT (Language Model), Data Science, Python, Natural language processing
Experience

PhD (Dr. rer. nat.) in Computational Life Sciences (Magna cum laude)
德国 北莱茵-威斯伐伦 波昂
Supervisor: Prof. Dr. Jürgen Bajorath Thesis: Chemical Language Model for Molecular Design Grade: 0.7 (Magna cum laude) Affiliated with the Bonn-Aachen International Center for Information Technology Lamarr Institute for Machine Learning and Artificial Intelligence LIMES Program Unit Chemical Biology and Medicinal Chemistry

AI Drug Design Scientist
Nanjing, Jiangsu, China
- Developed an AI-driven computational platform to address multidimensional challenges in drug discovery. - 3D pocket-based molecular generation using generative AI. - Bioactivity and ADME/T prediction with predictive machine learning. - Drug-target interaction prediction. - AI application in DNA Encoded Compound Library.
Hengwei Chen's Contact Information
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