Alán Aspuru-Guzik honoured with Heinrich Emanuel Merck Award for Computational Sciences

The Heinrich Emanuel Merck Award was awarded to Alán Aspuru-Guzik on June 28, 2025, recognizing groundbreaking innovation in computational sciences.

Alán Aspuru-Guzik talks about the interplay of chemistry and information in Lindau. (photo: supplied)

According to a press release from the science and technology company Merck, the award honours “extraordinary contributions in the integration of advanced computational methods with scientific discovery.” It celebrates current innovators in tribute to namesake Heinrich Emanuel Merck’s legacy of scientific curiosity and innovation.

Aspuru-Guzik is jointly appointed as Professor at the Department of Chemistry and the Department of Computer Science. Receiving the prize in Lindau, Switzerland, he said, “My research interests are in areas that are poised to disrupt the chemical sciences. We have pioneered algorithms for near-term quantum computers, artificial intelligence and robotics for new materials. Recently, we have focused strongly on AI agents that do science.”

“Receiving the Heinrich Emanuel Merck Award is a testament to the exceptionally talented, motivated and collaborative Matter Lab research group that we have assembled at the University of Toronto.”

Laura Matz, chief science and technology officer at Merck, also spoke of cooperation and collaboration, “Today we celebrate not just individual achievement, but a vision for a future where scientific breakthroughs transform lives and create new pathways for innovation.”

Aspuru-Guzik was lauded at the event as “a leading researcher, at the intersection of quantum information, quantum computing, artificial intelligence, automation and chemistry, dedicated to accelerating scientific discovery and finding novel materials.”

“His work includes utilizing generative machine learning to optimize wave functions for quantum simulations,” read the press release. “Additionally, he has made significant contributions in creating self-driving laboratories (SDLs) that leverage Al and automation.”

The Matter Lab’s innovative work, it noted, includes integrating quantum components into drug discovery pipelines, showcasing the potential of hybrid quantum-classical systems in generating viable drug candidates.

Aspuru-Guzik delivered a talk at the Lindau award ceremony, entitled, “The materials for tomorrow, today.” In it, he argued that the interplay between chemistry and information started four billion years ago and continues evolving thanks to the availability of AI algorithms. "Eventually they become autonomous research scientists."

— Original story by Alyx Dellamonica for the Department of Chemistry

U of T computer scientists highlighted in BetaKit's 'Most Ambitious' issue

(Photo: Matthew Volpe)

More than two dozen startups and entrepreneurs from the University of Toronto community are recognized in BetaKit’s first ‘Most Ambitious’ issue.

The online tech publication’s special issue aims to spotlight the “big swings” taken in tech and innovation in Canada.

Of the 85 tech players mentioned in the issue, nearly one third have a connection to U of T.

Among the people and companies recognized with ties to the Department of Computer Science are:

• Waabi, the autonomous trucking company founded by Professor Raquel Urtasun

• Cohere, the enterprise AI company launched by alumni Nick Frosst and Aidan Gomez; and former computer science student Ivan Zhang

• Associate Professor Jimmy Ba, founding member of xAI

• Alumnus and recent honorary degree recipient Ilya Sutskever, co-founder of OpenAI, and more recently, Safe SuperIntelligence

“This list demonstrates just how integral U of T-affiliated companies are to Canada’s innovation landscape in crucial fields ranging from sustainability and space tech to health care and transportation,” says Leah Cowen, vice-president, research and innovation, and strategic initiatives.

“The university has long been committed to generating big ideas and game-changing research — and then providing the support necessary for ambitious entrepreneurs to move those discoveries out of the lab and into the world where they can have the most impact.”

With files from U of T Celebrates