70 citations · 72 across the 3 of their papers we have counts for
3 papers
cs.LG2025
Reasoning-Enhanced Large Language Models for Molecular Property Prediction
Jiaxi Zhuang, Yaorui Shi, Jue Hou +8
Molecular property prediction is crucial for drug discovery and materials science, yet existing approaches suffer from limited interpretability, poor cross-task generalization, and…
physics.chem-ph2023★ 70 cited
MLatom 3: Platform for machine learning-enhanced computational chemistry simulations and workflows
Pavlo O. Dral, Fuchun Ge, Yi-Fan Hou +15
Machine learning (ML) is increasingly becoming a common tool in computational chemistry. At the same time, the rapid development of ML methods requires a flexible software framewor…
eess.SP2021★ 2 cited
Potential Advantages of Peak Picking Multi-Voltage Threshold Digitizer in Energy Determination in Radiation Measurement
Kezhang Zhu, Junhua Mei, Yuming Su +6
The Multi-voltage Threshold (MVT) method, which samples the signal by certain reference voltages, has been well developed as being adopted in pre-clinical and clinical digital posi…