52 citations · 60 across the 7 of their papers we have counts for
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cs.LG2025★ 1 cited
AutoSDT: Scaling Data-Driven Discovery Tasks Toward Open Co-Scientists
Yifei Li, Hanane Nour Moussa, Ziru Chen +16
Despite long-standing efforts in accelerating scientific discovery with AI, building AI co-scientists remains challenging due to limited high-quality data for training and evaluati…
cs.LG2025
Large Language Models for Controllable Multi-property Multi-objective Molecule Optimization
Vishal Dey, Xiao Hu, Xia Ning
In real-world drug design, molecule optimization requires selectively improving multiple molecular properties up to pharmaceutically relevant levels, while maintaining others that…
cs.LG2025★ 1 cited
GeLLMO: Generalizing Large Language Models for Multi-property Molecule Optimization
Vishal Dey, Xiao Hu, Xia Ning
Despite recent advancements, most computational methods for molecule optimization are constrained to single- or double-property optimization tasks and suffer from poor scalability…