CuspAI is a technology company focused on applying artificial intelligence to materials discovery and design for the chemical and environmental sectors. Its approach combines machine learning with computational chemistry and domain data to predict structure–property relationships, explore large design spaces, and identify candidates with targeted performance.
The company’s platform supports the discovery and optimization of functional materials—such as adsorbents, porous materials, catalysts, and related chemistries—for applications including separations, water treatment, and decarbonization. By integrating in silico screening with iterative experimental validation, CuspAI helps shorten R&D cycles, prioritize synthetically accessible candidates, and balance multi‑objective criteria like selectivity, stability, and cost. It collaborates with industrial and research partners to translate computational insights into practical materials solutions.