Machine learning unravels quantum atomic vibrations in materials

Machine learning unravels quantum atomic vibrations in materials

Credit: Rosa Romano, EAS Communications/Caltech Caltech scientists have developed an artificial intelligence (AI)–based method that dramatically…

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AI is dreaming up millions of new materials. Are they any good?

AI is dreaming up millions of new materials. Are they any good?

When the pioneering artificial intelligence (AI) firm Google DeepMind announced almost two years ago that it…

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AI-driven system blends literature, experiments and robotics to discover new materials

AI-driven system blends literature, experiments and robotics to discover new materials

Example of AI for experimental diagnostics with the wood sample stages. Credit: Nature (2025). DOI: 10.1038/s41586-025-09640-5…

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Materials Graph Library (MatGL), an open-source graph deep learning library for materials science and chemistry

Materials Graph Library (MatGL), an open-source graph deep learning library for materials science and chemistry

Chen, C., Zuo, Y., Ye, W., Li, X., Deng, Z. & Ong, S. P. A critical…

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Machine learning predicts magnetic properties of materials

Machine learning predicts magnetic properties of materials

(A) Main components of the Spin-informed GNN architecture. (B) Performance evaluation of Spin-informed GNNs compared to…

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Machine learning models for predicting interaction affinity energy between human serum proteins and hemodialysis membrane materials

Machine learning models for predicting interaction affinity energy between human serum proteins and hemodialysis membrane materials

Baseline data assessment The foundation of this study is anchored on a rigorously curated dataset, meticulously…

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