Zhang, Zuobai
- Neural Bellman-Ford Networks: A General Graph Neural Network Framework for Link Prediction
2021/06/13 by Zhaocheng Zhu, Zuobai Zhang, Zhu, Zhaocheng +5 · 36 citations
Computer Science · Physics and Astronomy · #Advanced Graph Neural Networks #Complex Network Analysis Techniques #FOS: Computer and information sciences #Machine Learning (cs.LG) #Topic Modeling
- Protein Representation Learning by Geometric Structure Pretraining
2022/03/11 by Zuobai Zhang, Minghao Xu, Zhang, Zuobai +10 · 18 citations
Biochemistry, Genetics and Molecular Biology · #Machine Learning in Bioinformatics #Protein Structure and Dynamics #Bioinformatics and Genomic Networks
- Proteina: Scaling Flow-based Protein Structure Generative Models
2025/03/02 by Geffner, Tomas, Didi, Kieran, Zhang, Zuobai +8 · 38 citations
#FOS: Computer and information sciences #Machine Learning (cs.LG)
- PEER: A Comprehensive and Multi-Task Benchmark for Protein Sequence Understanding
2022/06/05 by Minghao Xu, Xu, Minghao, Zuobai Zhang +13 · 11 citations
Biochemistry, Genetics and Molecular Biology · #FOS: Computer and information sciences #Genomics and Phylogenetic Studies #Machine Learning (cs.LG) #Machine Learning in Bioinformatics #Protein Structure and Dynamics
- Str2Str: A Score-based Framework for Zero-shot Protein Conformation Sampling
2023/06/05 by Jiarui Lu, Lu, Jiarui, Bozitao Zhong +3 · 7 citations
Biochemistry, Genetics and Molecular Biology · #Metabolomics and Mass Spectrometry Studies #Protein Structure and Dynamics
- Neural-Symbolic Models for Logical Queries on Knowledge Graphs
2022/05/16 by Zhaocheng Zhu, Mikhail Galkin, Zhu, Zhaocheng +5 · 5 citations
Computer Science · #Advanced Graph Neural Networks #Artificial Intelligence (cs.AI) #Bayesian Modeling and Causal Inference #FOS: Computer and information sciences #Machine Learning (cs.LG) #Topic Modeling
- Effects of Stubbornness on Opinion Dynamics
2022/08/08 by Wanyue Xu, Xu, Wanyue, Liwang Zhu +7 · 4 citations
Physics and Astronomy · Social Sciences · #Complex Network Analysis Techniques #FOS: Computer and information sciences #Opinion Dynamics and Social Influence #Social Media and Politics #Social and Information Networks (cs.SI)
- Evaluating representation learning on the protein structure universe
2024/06/19 by Arian R. Jamasb, Jamasb, Arian R., Alex Morehead +19 · 6 citations
Biochemistry, Genetics and Molecular Biology · #Biomolecules (q-bio.BM) #FOS: Biological sciences #FOS: Computer and information sciences #Genetics, Bioinformatics, and Biomedical Research #Machine Learning (cs.LG) #Machine Learning in Bioinformatics #Protein Structure and Dynamics
- TorchDrug: A Powerful and Flexible Machine Learning Platform for Drug Discovery
2022/02/16 by Zhu, Zhaocheng, Shi, Chence, Zhang, Zuobai +12 · 3 citations
#FOS: Computer and information sciences #Machine Learning (cs.LG)
- Multi-Scale Representation Learning for Protein Fitness Prediction
2024/12/02 by Zhang, Zuobai, Notin, Pascal, Huang, Yining +5 · 7 citations
#Biomolecules (q-bio.BM) #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG)
- La-Proteina: Atomistic Protein Generation via Partially Latent Flow Matching
2025/07/13 by Tomas Geffner, Kieran Didi, Geffner, Tomas +15 · 13 citations
Engineering · #Innovative Microfluidic and Catalytic Techniques Innovation
- FusionRetro: Molecule Representation Fusion via In-Context Learning for Retrosynthetic Planning
2022/09/30 by Songtao Liu, Liu, Songtao, Tu, Zhengkai +13 · 3 citations
Biochemistry, Genetics and Molecular Biology · Computer Science · Materials Science · #Biomolecules (q-bio.BM) #Chemical Physics (physics.chem-ph) #Chemical Synthesis and Analysis #Computational Drug Discovery Methods #FOS: Biological sciences #FOS: Computer and information sciences #FOS: Physical sciences #Machine Learning (cs.LG) #Machine Learning in Materials Science #Quantitative Methods (q-bio.QM)
- DiffPack: A Torsional Diffusion Model for Autoregressive Protein Side-Chain Packing
2023/06/01 by Yangtian Zhan, Zhang, Yangtian, Zuobai Zhang +7 · 3 citations
Biochemistry, Genetics and Molecular Biology · #Enzyme Production and Characterization #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG) #Protein Structure and Dynamics #Protein purification and stability #Quantitative Methods (q-bio.QM)
- Cell-ontology guided transcriptome foundation model
2024/08/22 by Xinyu Yuan, Yuan, Xinyu, Zuobai Zhang +11 · 4 citations
Biochemistry, Genetics and Molecular Biology · #Artificial Intelligence (cs.AI) #Bioinformatics and Genomic Networks #Biomedical Text Mining and Ontologies #FOS: Computer and information sciences #Gene expression and cancer classification #Machine Learning (cs.LG)
- A Systematic Study of Joint Representation Learning on Protein Sequences and Structures
2023/03/11 by Zuobai Zhang, Zhang, Zuobai, Wang, Chuanrui +10 · 2 citations
Biochemistry, Genetics and Molecular Biology · Materials Science · #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning in Bioinformatics #Machine Learning in Materials Science #Protein Structure and Dynamics #Quantitative Methods (q-bio.QM)
- Pre-Training Protein Encoder via Siamese Sequence-Structure Diffusion Trajectory Prediction
2023/01/28 by Zuobai Zhang, Zhang, Zuobai, Minghao Xu +9 · 1 citation
Biochemistry, Genetics and Molecular Biology · #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning in Bioinformatics #Protein Structure and Dynamics #RNA and protein synthesis mechanisms
- Structure-Informed Protein Language Model
2024/02/07 by Zhang, Zuobai, Lu, Jiarui, Chenthamarakshan, Vijil +3 · 1 citation
#Biomolecules (q-bio.BM) #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG)
- Opinion Dynamics Incorporating Higher-Order Interactions
2021/02/06 by Zuobai Zhang, Wanyue Xu, Zhang, Zuobai +5 · 1 citation
Physics and Astronomy · #Complex Network Analysis Techniques #Computers and Society (cs.CY) #FOS: Computer and information sciences #Opinion Dynamics and Social Influence #Quantum many-body systems #Social and Information Networks (cs.SI)
- Means of Hitting Times for Random Walks on Graphs: Connections, Computation, and Optimization
2024/12/15 by Haisong Xia, Wanyue Xu, Xia, Haisong +5 · 2 citations
Computer Science · Physics and Astronomy · #Complex Network Analysis Techniques #Data Visualization and Analytics #FOS: Computer and information sciences #Graph Theory and Algorithms #Social and Information Networks (cs.SI)
- PDB-Struct: A Comprehensive Benchmark for Structure-based Protein Design
2023/11/30 by Chuanrui Wang, Bozitao Zhong, Wang, Chuanrui +9 · 1 citation
Biochemistry, Genetics and Molecular Biology · #FOS: Biological sciences #FOS: Computer and information sciences #Machine Learning (cs.LG) #Machine Learning in Bioinformatics #Microbial Metabolic Engineering and Bioproduction #Protein Structure and Dynamics #Quantitative Methods (q-bio.QM)