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38 积分 2022-08-03 加入
Mechanism Switch Between Radical‐Polar Crossover and Radical Buffering
8天前
已完结
Machine learning interatomic potentials at the centennial crossroads of quantum mechanics
18天前
已完结
Evidential deep learning for interatomic potentials
1个月前
已关闭
The Evolution of Machine Learning Potentials for Molecules, Reactions and Materials
1个月前
已完结
MACE: Higher Order Equivariant Message Passing Neural Networks for Fast and Accurate Force Fields
1个月前
已完结
Accelerating Transition State Search and Ligand Screening for Organometallic Catalysis with Reactive Machine Learning Potential
1个月前
已完结
Cu-catalysed enantioselective radical heteroatomic S–O cross-coupling
3个月前
已完结
Artificial Optoelectronic Synapse Based on Purely Inorganic Polyoxometalates Crystalline Materials Enabling Reservoir Computing and Neuromorphic Vision
3个月前
已完结
Machine Learning‐Assisted Prediction of Ground‐ and Excited‐State Redox Potentials in Iridium(III) Photocatalysts
3个月前
已完结
Stereoretentive Radical Cross-Coupling
4个月前
已完结
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