Large Language Models for Chemists: Applications and Insights

In recent years, LLMs (such as ChatGPT, Claude, DeepSeek, LLaMA, and other transformer-based models) have emerged as powerful tools in chemistry, enabling new approaches to scientific discovery. While many chemists, from undergraduate students to researchers, find these AI models interesting, they may lack a certain knowledge base to better integrate these tools into their daily research.

Large Language Models for Chemists breaks down that barrier by demystifying how LLMs work in an accessi...