8 citations · 8 across the 2 of their papers we have counts for
2 papers
cs.LG2023
Molecular Property Prediction Based on Graph Structure Learning
Bangyi Zhao, Weixia Xu, Jihong Guan +1
Molecular property prediction (MPP) is a fundamental but challenging task in the computer-aided drug discovery process. More and more recent works employ different graph-based mode…
q-bio.BM2023★ 8 cited
Activity Cliff Prediction: Dataset and Benchmark
Ziqiao Zhang, Bangyi Zhao, Ailin Xie +2
Activity cliffs (ACs), which are generally defined as pairs of structurally similar molecules that are active against the same bio-target but significantly different in the binding…