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20242026
most citedLeveraging Data Mining, Active Learning, and Domain Adaptation in a Multi-Stage, Machine Learning-Driven Approach for the Efficient Discovery of Advanced Acidic Oxygen Evolution Electrocatalysts

2 citations · 2 across the 3 of their papers we have counts for

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cs.LG2025

Hierarchical Deep Research with Local-Web RAG: Toward Automated System-Level Materials Discovery

Rui Ding, Rodrigo Pires Ferreira, Yuxin Chen +1

We present a long-horizon, hierarchical deep research (DR) agent designed for complex materials and device discovery problems that exceed the scope of existing Machine Learning (ML…

cs.LG2024

YZS-model: A Predictive Model for Organic Drug Solubility Based on Graph Convolutional Networks and Transformer-Attention

Chenxu Wang, Haowei Ming, Jian He +2

Accurate prediction of drug molecule solubility is crucial for therapeutic effectiveness and safety. Traditional methods often miss complex molecular structures, leading to inaccur…