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cs.LG2024
WelQrate: Defining the Gold Standard in Small Molecule Drug Discovery Benchmarking
Yunchao Liu, Ha Dong, Xin Wang +8
While deep learning has revolutionized computer-aided drug discovery, the AI community has predominantly focused on model innovation and placed less emphasis on establishing best b…
cs.LG2024
Edge Classification on Graphs: New Directions in Topological Imbalance
Xueqi Cheng, Yu Wang, Yunchao Liu +3
Recent years have witnessed the remarkable success of applying Graph machine learning (GML) to node/graph classification and link prediction. However, edge classification task that…