An Image-Enhanced Molecular Graph Representation Learning Framework
Abstract
The nuclear norm (NN) has been widely explored in matrix recovery problems, such as Robust PCA and matrix completion, leveraging the inherent global low-rank structure of the data. In this study, we introduce a new modified nuclear norm (MNN) framework, where the MNN family norms are defined by adopting suitable transformations and performing the NN on the transformed matrix. The MNN framework offers two main advantages: (1) it jointly captures both local information and global low-rankness without requiring trade-off parameter tuning; (2) under mild assumptions on the transformation, we provide theoretical recovery guarantees for both Robust PCA and MC tasks—an achievement not shared by existing methods that combine local and global information. Thanks to its general and flexible design, MNN can accommodate various proven transformations, enabling a unified and effective approach to structured low-rank recovery. Extensive experiments demonstrate the effectiveness of our method. Code and supplementary material are available at https://github.com/andrew-pengjj/modified_nuclear_norm.
Cite
Text
Xiang et al. "An Image-Enhanced Molecular Graph Representation Learning Framework." International Joint Conference on Artificial Intelligence, 2024. doi:10.24963/ijcai.2024/675Markdown
[Xiang et al. "An Image-Enhanced Molecular Graph Representation Learning Framework." International Joint Conference on Artificial Intelligence, 2024.](https://mlanthology.org/ijcai/2024/xiang2024ijcai-image/) doi:10.24963/ijcai.2024/675BibTeX
@inproceedings{xiang2024ijcai-image,
title = {{An Image-Enhanced Molecular Graph Representation Learning Framework}},
author = {Xiang, Hongxin and Jin, Shuting and Xia, Jun and Zhou, Man and Wang, Jianmin and Zeng, Li and Zeng, Xiangxiang},
booktitle = {International Joint Conference on Artificial Intelligence},
year = {2024},
pages = {6107-6115},
doi = {10.24963/ijcai.2024/675},
url = {https://mlanthology.org/ijcai/2024/xiang2024ijcai-image/}
}