A new start-up called PsiThera has spun out of Roivant Sciences with $47 million and a computational drug discovery platform ...

Chemists at the U.S. Department of Energy's (DOE) Brookhaven National Laboratory have designed a new way to convert abundant carbon dioxide (CO 2) into formate (HCO 2 ...

For decades, Arieh Warshel, USC Distinguished Professor of Chemistry and a 2013 Nobel laureate, has used computer simulations ...

A new study has developed a powerful computational method that can detect how genes interact with each other to influence ...

Deadly and destructive, earthquakes remain unpredictable, but faster models that look beneath the ground, can help better ...

A team led by Pei-Yi Wu and Sheng-Tong Sun at Donghua University reported a strong hydrogel fiber material with water-induced ...

Hitchcock and Pande will advise on the continued development and scaling of insitro's AI-driven ChemML™ platform as it is deployed across insitro's pipeline and partner programs. Their guidance will ...

Ten scientists at Scripps Research were honored recently on Clarivate’s annual Highly Cited Researchers list for 2025. The annual list identifies researchers whose publications rank in the top 1 ...

Using a smart computational search, scientists discovered a catalyst ingredient that finally makes tough alkyl ketones behave the way chemists want. The reaction now runs cleanly and reliably, opening ...

Parasitic diseases continue to impose a substantial public health and socioeconomic burden, particularly in low- and middle-income regions across Latin ...

Abstract: The National Renewable Energy Laboratory’s (NREL’s) computational sciences center hosts the largest high-performance computing (HPC) capabilities dedicated to energy research while ...

Champaign have developed a new theoretical framework that could dramatically reduce the cost and complexity of predicting chemical reaction energetics without sacrificing accuracy. Led by chemical and ...