In depth

AI prompts

The chemistry community should ban drawing chemical structures with generative AI, chemists warn

AIs like Microsoft’s Copilot, Google’s Gemini and OpenAI’s ChatGPT still make serious errors rendering structural formulae

Data center

Modelling suggests waste heat from AI data centres could power carbon capture and water purification

Analysis considering thermodynamics, economics and emissions shows how AI could flip its environmental footprint to become both water-positive and carbon-negative

Two organic chemical structures.

Antibiotics designed with the help of AI attack bacteria in entirely new ways

Two new compounds display potent activity against deadly drug-resistant bacteria

AI tools turned to creating designer proteins for personalised cancer therapies and antibiotics

Powerful new class of AI model could dramatically speed up process of producing new kinds of drug candidates

LLMs could rewrite how AIs predict reactions and plan syntheses

Chemists welcome approach but warn that unthinking dependence on AI should be avoided

As AI-designed drug looks to pass final hurdle, will this tech change drug discovery forever?

AI-led drug for chronic lung disease set to enter phase 3 clinical trials, though experts remain divided on AI’s impact in pharma

‘CrystalGPT’ set to enhance how chemists design crystals in silico

Model for predicting molecular crystal properties is readily adaptable to specific tasks, even with limited data

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