1.2k citations · 1.3k across the 31 of their papers we have counts for
5 papers · 1 filter
Trust Region Preference Approximation: A simple and stable reinforcement learning algorithm for LLM reasoning
Xuerui Su, Shufang Xie, Guoqing Liu +7
Recently, Large Language Models (LLMs) have rapidly evolved, approaching Artificial General Intelligence (AGI) while benefiting from large-scale reinforcement learning to enhance H…
FABind: Fast and Accurate Protein-Ligand Binding
Qizhi Pei, Kaiyuan Gao, Lijun Wu +7
Modeling the interaction between proteins and ligands and accurately predicting their binding structures is a critical yet challenging task in drug discovery. Recent advancements i…
De Novo Molecular Generation via Connection-aware Motif Mining
Zijie Geng, Shufang Xie, Yingce Xia +6
De novo molecular generation is an essential task for science discovery. Recently, fragment-based deep generative models have attracted much research attention due to their flexibi…
Unified 2D and 3D Pre-Training of Molecular Representations
Jinhua Zhu, Yingce Xia, Lijun Wu +5
Molecular representation learning has attracted much attention recently. A molecule can be viewed as a 2D graph with nodes/atoms connected by edges/bonds, and can also be represent…
DDG-DA: Data Distribution Generation for Predictable Concept Drift Adaptation
Wendi Li, Xiao Yang, Weiqing Liu +2
In many real-world scenarios, we often deal with streaming data that is sequentially collected over time. Due to the non-stationary nature of the environment, the streaming data di…