UMA: A Family of Universal Models for Atoms

NeurIPSSpotlight2025

Authors: Brandon M Wood, Misko Dzamba, Xiang Fu, Meng Gao, Muhammed Shuaibi, Luis Barroso-Luque, Kareem Abdelmaqsoud, Vahe Gharakhanyan, John R. Kitchin, Daniel S. Levine, Kyle Michel, Anuroop Sriram, Taco Cohen, Abhishek Das, Sushree Jagriti Sahoo, Ammar Rizvi, Zachary Ward Ulissi, C. Lawrence Zitnick
Venue: NeurIPS 2025
Track: Spotlight

TL;DR

The ability to quickly and accurately compute properties from atomic simulations is critical for advancing a large number of applications in chemistry and materials science including drug discovery, e…

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Topics

drug

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