30 citations · 70 across the 13 of their papers we have counts for
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cs.LG2024
Physical Consistency Bridges Heterogeneous Data in Molecular Multi-Task Learning
Yuxuan Ren, Dihan Zheng, Chang Liu +7
In recent years, machine learning has demonstrated impressive capability in handling molecular science tasks. To support various molecular properties at scale, machine learning mod…
cs.LG2022★ 4 cited
Exploring the Limits of Differentially Private Deep Learning with Group-wise Clipping
Jiyan He, Xuechen Li, Da Yu +6
Differentially private deep learning has recently witnessed advances in computational efficiency and privacy-utility trade-off. We explore whether further improvements along the tw…
cs.LG2022★ 26 cited
Benchmarking Graphormer on Large-Scale Molecular Modeling Datasets
Yu Shi, Shuxin Zheng, Guolin Ke +7
This technical note describes the recent updates of Graphormer, including architecture design modifications, and the adaption to 3D molecular dynamics simulation. With these simple…