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AI and Chemistry Unite: A Global Hackathon Sparks Innovation

Irvine, CA, USAWednesday, November 12, 2025
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Over 1,200 Participants from 16 Countries

A recent global AI hackathon brought together 1,200+ participants from 16 countries to address real-world challenges in chemistry and materials science. The event, held at Duke University and other locations, tasked teams with developing prototypes using large language models (LLMs). Abstrax, a company specializing in flavor science, sponsored the event and awarded prizes to top teams.

Innovative AI-Driven Projects

The hackathon focused on applying AI to chemistry, with groundbreaking projects such as:

  • SmeLLMap: Mapped receptor-odor relationships.
  • ATOMS Lab: Predicted sensory attributes with limited data.
  • ChromatographyMiner: Developed a pipeline for analyzing chemical compounds.

These innovations could revolutionize fields like flavor science and materials research.

Abstrax's Commitment to AI in Chemistry

Abstrax's involvement underscores its dedication to advancing AI-driven tools in chemistry. Kevin Koby, CEO of Abstrax, emphasized the importance of collaboration between AI researchers and chemists. Dr. Qianxiang Ai, a senior researcher at Abstrax, noted that the projects demonstrated how AI can accelerate discoveries in areas like olfaction and chromatography.

Growing Interest in AI for Science

The hackathon highlighted the rising interest in AI for scientific applications. Companies like Lila Sciences and Biostate AI were also involved, reflecting a broader trend of using AI to solve complex scientific problems. The event received recognition from Duke University and the official hackathon website.

Winning Teams to Present at ACS Spring 2026 Conference

Two of the winning teams, SmeLLMap and ATOMS Lab, have been invited to present their findings at the American Chemical Society (ACS) Spring 2026 Conference. This academia-industry collaboration could lead to further advancements in computational chemistry. A showcase event later this year will feature live demonstrations from the winning teams.

Abstrax: Leader in Flavor Science

Abstrax is a pioneer in flavor science, known for its work in cannabis-inspired terpene innovation. The company combines research and creativity to develop products like hemp-derived terpene blends and mood-enhancing formulations. Abstrax's work has earned recognition from Forbes, Fast Company, and the Inc. 5000 list of fastest-growing companies.

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