To harness the power of AI and computational tools to design and predict the structure, function, and interactions of complex biomolecules.
This area focuses on applying data-driven generative AI models to accelerate the design of novel proteins, enzymes, and molecular therapies. By integrating large datasets and machine learning algorithms, we create generative & predictive models that guide biomolecular engineering efforts, optimizing the discovery and functionality of biological systems.
Examples include generating new protein sequences for therapeutic purposes or designing enzyme variants with enhanced activity for industrial or medical applications.
Development of generative AI for therapeutics in various modalities
Computational protein design (CPD) powered by generative AI
Computation protein design powered by physical principle
Structure-based generative modeling for de novo drug discovery