colinjay
colinjay16.bsky.social
colinjay
@colinjay16.bsky.social
xiamen university, phd, ai for science
Reposted by colinjay
📢 Jun Cheng and colleagues introduce NMRNet, a deep learning framework for predicting NMR chemical shifts. www.nature.com/articles/s43... #chemsky

🔓https://rdcu.be/efvfB
Toward a unified benchmark and framework for deep learning-based prediction of nuclear magnetic resonance chemical shifts - Nature Computational Science
A deep learning framework (NMRNet) is developed to model atomic environments for predicting NMR chemical shifts. A benchmark dataset, nmrshiftdb2-2024, is also established to provide a standardized so...
www.nature.com
March 28, 2025 at 1:27 PM