Hangzhou, Zhejiang, China.

Jun Xia

Advanced
@junxia97

Ph.D. student at Westlake University & Zhejiang University

junxia97.github.io/

awesome-pretrain-on-molecules. [IJCAI 2023 survey track]A curated list of resources for chemical pre-trained models

541

Mole-BERT. [ICLR 2023] "Mole-BERT: Rethinking Pre-training Graph Neural Networks for Molecules"

136

SimGRACE. [WWW 2022] "SimGRACE: A Simple Framework for Graph Contrastive Learning without Data Augmentation"

83

ProGCL. [ICML 2022] "ProGCL: Rethinking Hard Negative Mining in Graph Contrastive Learning"

47

IFM. [NeurIPS 2023] "Understanding the Limitations of Deep Models for Molecular Property Prediction: Insights and Solutions"

12

awesome-molecular-graph-representation-learning. A curated list of resources for molecular graph representation learning.

7

DiscoGNNs. [ICDE 2024]Official implementation of ICDE 2024 paper "DiscoGNN: A Sample-Efficient Framework for Self-Supervised Graph Representation Learning"

5

OT-Cleaner. [ICASSP 2022]OT-Cleaner: Label Correction as Optimal Transport

3

SearchNovo. [ICLR 2025] Bridging the Gap between Database Search and De Novo Peptide Sequencing with SearchNovo

3
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