activity
20162025
most citedPre-training of Graph Neural Network for Modeling Effects of Mutations on Protein-Protein Binding Affinity

141 citations · 184 across the 7 of their papers we have counts for

collaborators

7 papers

q-bio.BM2025

Group Ligands Docking to Protein Pockets

Jiaqi Guan, Jiahan Li, Xiangxin Zhou +5

Molecular docking is a key task in computational biology that has attracted increasing interest from the machine learning community. While existing methods have achieved success, t…

q-bio.QM2024

FAFE: Immune Complex Modeling with Geodesic Distance Loss on Noisy Group Frames

Ruidong Wu, Ruihan Guo, Rui Wang +7

Despite the striking success of general protein folding models such as AlphaFold2(AF2, Jumper et al. (2021)), the accurate computational modeling of antibody-antigen complexes rema…

cs.LG2022★ 5 cited

Interpretable Geometric Deep Learning via Learnable Randomness Injection

Siqi Miao, Yunan Luo, Mia Liu +1

Point cloud data is ubiquitous in scientific fields. Recently, geometric deep learning (GDL) has been widely applied to solve prediction tasks with such data. However, GDL models a…

q-bio.BM2020★ 141 cited

Pre-training of Graph Neural Network for Modeling Effects of Mutations on Protein-Protein Binding Affinity

Xianggen Liu, Yunan Luo, Sen Song +1

Modeling the effects of mutations on the binding affinity plays a crucial role in protein engineering and drug design. In this study, we develop a novel deep learning based framewo…

cs.CV2019★ 17 cited

DeepMask: an algorithm for cloud and cloud shadow detection in optical satellite remote sensing images using deep residual network

Ke Xu, Kaiyu Guan, Jian Peng +2

Detecting and masking cloud and cloud shadow from satellite remote sensing images is a pervasive problem in the remote sensing community. Accurate and efficient detection of cloud…

cs.LG2019★ 17 cited

Sequence Modeling of Temporal Credit Assignment for Episodic Reinforcement Learning

Yang Liu, Yunan Luo, Yuanyi Zhong +3

Recent advances in deep reinforcement learning algorithms have shown great potential and success for solving many challenging real-world problems, including Go game and robotic app…

q-bio.QM2016★ 4 cited

Low-density locality-sensitive hashing boosts metagenomic binning

Yunan Luo, Jianyang Zeng, Bonnie Berger +1

Metagenomic binning is an essential task in analyzing metagenomic sequence datasets. To analyze structure or function of microbial communities from environmental samples, metagenom…