Jakub Kostal

Jakub Kostal is an Associate Professor of Chemistry and Director of the MS Environmental and Green Chemistry Program at George Washington University. He leads the Kostal Research Group, focusing on computational chemistry, green chemistry, and predictive toxicology. His work aims to develop computer models to predict chemical toxicity and design safer, sustainable chemicals.

Education: PhD from Yale University (2012), B.A. from Middlebury College (2006). He collaborates with the Lapkin Group at the University of Cambridge on sustainable process engineering using AI. His research team includes graduate students Jillian Brejnik, Diana Garnica Acevedo, and Geetesh Devineni.

Research interests center on reducing chemical hazards through computational methods, including predicting environmental persistence, optimizing chemical reactions for sustainability, and advancing machine learning tools for toxicity prediction. His team’s contributions include refining models for pesticide safety and designing bio-based alternatives.

Publications highlight advancements in quantum mechanics modeling, in silico toxicity prediction, and sustainable chemical design. He actively engages with policymakers, including speaking at the White House on sustainable chemistry strategies.