Jinlan Wang — accepted AI-conference papers

2024

MapLE: Matching Molecular Analogues Promptly with Low Computational Resources by Multi-Metrics Evaluation (Student Abstract)

Xiaojian Chen, Chuyue Liao, Yanhui Gu, Yafei Li, Jinlan Wang, Yi Chen +1

AAAI 2024technical

Matching molecular analogues is a computational chemistry and bioinformatics research issue which is used to identify molecules that are structurally or functionally similar to a target molecule. Recent studies on matching analogous molecules have predominantly concentrated on enhancing effectivenes…

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2023

HaPPy: Harnessing the Wisdom from Multi-Perspective Graphs for Protein-Ligand Binding Affinity Prediction (Student Abstract)

Xianfeng Zhang, Yanhui Gu, Guandong Xu, Yafei Li, Jinlan Wang, Zhenglu Yang

AAAI 2023technical

Gathering information from multi-perspective graphs is an essential issue for many applications especially for proteinligand binding affinity prediction. Most of traditional approaches obtained such information individually with low interpretability. In this paper, we harness the rich information fr…

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