Mechanochemistry is a growing field for chemical reactions that proceed in the solid state in the absence, or with minuscule ...
Figure 1. LoRA-Chem: From Model Customization to Organic Chemistry Reaction Tasks. (a) Several machine learning algorithm paradigms applied to organic chemistry. (b) Inspired by AI-driven image style ...
Researchers at the Institute for Chemical Reaction Design and Discovery (WPI-ICReDD) have demonstrated the expanded use of a computational method called the artificial-force-induced reaction (AFIR) ...
Researchers at EPFL have developed 'Synthegy', a framework that uses large language models to evaluate and guide chemical synthesis planning and reaction mechanism analysis through natural-language ...
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Chemistry’s new era of smart reactions
From light-fueled, self-regenerating catalysts to biocompatible couplings in live cells, chemistry is entering a smarter, greener era. Researchers are merging computational insight, sustainable design ...
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