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20162023
most cited3DLinker: An E(3) Equivariant Variational Autoencoder for Molecular Linker Design

24 citations · 63 across the 9 of their papers we have counts for

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9 papers · 1 filter

cs.LG2023

Graph Contrastive Learning Meets Graph Meta Learning: A Unified Method for Few-shot Node Tasks

Hao Liu, Jiarui Feng, Lecheng Kong +3

Graph Neural Networks (GNNs) have become popular in Graph Representation Learning (GRL). One fundamental application is few-shot node classification. Most existing methods follow t…

cs.LG2023★ 3 cited

Rethinking the Power of Graph Canonization in Graph Representation Learning with Stability

Zehao Dong, Muhan Zhang, Philip R. O. Payne +5

The expressivity of Graph Neural Networks (GNNs) has been studied broadly in recent years to reveal the design principles for more powerful GNNs. Graph canonization is known as a t…

cs.LG2023★ 13 cited

CktGNN: Circuit Graph Neural Network for Electronic Design Automation

Zehao Dong, Weidong Cao, Muhan Zhang +3

The electronic design automation of analog circuits has been a longstanding challenge in the integrated circuit field due to the huge design space and complex design trade-offs amo…

cs.LG2023

Extending the Design Space of Graph Neural Networks by Rethinking Folklore Weisfeiler-Lehman

Jiarui Feng, Lecheng Kong, Hao Liu +4

Message passing neural networks (MPNNs) have emerged as the most popular framework of graph neural networks (GNNs) in recent years. However, their expressive power is limited by th…

cs.LG2023

Time Associated Meta Learning for Clinical Prediction

Hao Liu, Muhan Zhang, Zehao Dong +5

Rich Electronic Health Records (EHR), have created opportunities to improve clinical processes using machine learning methods. Prediction of the same patient events at different ti…

cs.LG2022★ 24 cited

3DLinker: An E(3) Equivariant Variational Autoencoder for Molecular Linker Design

Yinan Huang, Xingang Peng, Jianzhu Ma +1

Deep learning has achieved tremendous success in designing novel chemical compounds with desirable pharmaceutical properties. In this work, we focus on a new type of drug design pr…