activity
20222026
most citedAdvances of Deep Learning in Protein Science: A Comprehensive Survey

7 citations · 12 across the 14 of their papers we have counts for

collaborators

16 papers

cs.LG2026

E-OPSD: Taming Entropy Overshoot in On-Policy Self-Distillation

Yifei Liu, Minghao Fang, Xinyu Gu +6

On-policy self-distillation (OPSD) provides dense token-level supervision without a second model: one network acts as teacher with the reference solution and as student with only t…

cs.LG2026

Bison: Cross-Dataset Learning for Unseen-Compound Perturbation Prediction

Yunfan Liu, Kasra Ghorbani, Yufei Huang +6

Predicting transcriptional responses to unseen compounds is limited by fragmented chemical coverage and heterogeneous experimental platforms and gene panels. To assess molecular ge…

q-bio.QM2026

MetaGEM: Bottom-Up Reconstruction of Genome-Scale Metabolic Networks via Deep Enzyme-Metabolite Anchoring

Weiyu Xiao, Jiangbin Zheng, Stan Z. Li

Genome-scale metabolic models (GEMs) are essential tools for systems biology and rational chassis design, but conventional top-down reconstruction depends heavily on sequence homol…

q-bio.CB2026

TCRTransBench: A Comprehensive Benchmark for Bidirectional TCR-Peptide Sequence Generation

Yiming Wang, Weiyu Xiao, Jiangbin Zheng +1

T-cell receptor (TCR) interactions with antigenic peptides underpin adaptive immunity and are pivotal for personalized immunotherapy and vaccine development. Despite recent progres…

cs.LG2025

Departures: Distributional Transport for Single-Cell Perturbation Prediction with Neural Schrödinger Bridges

Changxi Chi, Yufei Huang, Jun Xia +4

Predicting single-cell perturbation outcomes directly advances gene function analysis and facilitates drug candidate selection, making it a key driver of both basic and translation…

cs.LG2025★ 1 cited

Multimodal Regression for Enzyme Turnover Rates Prediction

Bozhen Hu, Cheng Tan, Siyuan Li +4

The enzyme turnover rate is a fundamental parameter in enzyme kinetics, reflecting the catalytic efficiency of enzymes. However, enzyme turnover rates remain scarce across most org…

q-bio.QM2024

DapPep: Domain Adaptive Peptide-agnostic Learning for Universal T-cell Receptor-antigen Binding Affinity Prediction

Jiangbin Zheng, Qianhui Xu, Ruichen Xia +1

Identifying T-cell receptors (TCRs) that interact with antigenic peptides provides the technical basis for developing vaccines and immunotherapies. The emergent deep learning metho…

q-bio.QM2024★ 1 cited

Pan-protein Design Learning Enables Task-adaptive Generalization for Low-resource Enzyme Design

Jiangbin Zheng, Ge Wang, Han Zhang +1

Computational protein design (CPD) offers transformative potential for bioengineering, but current deep CPD models, focused on universal domains, struggle with function-specific de…

q-bio.BM2024

MetaEnzyme: Meta Pan-Enzyme Learning for Task-Adaptive Redesign

Jiangbin Zheng, Han Zhang, Qianqing Xu +2

Enzyme design plays a crucial role in both industrial production and biology. However, this field faces challenges due to the lack of comprehensive benchmarks and the complexity of…

q-bio.GN2024★ 1 cited

VQDNA: Unleashing the Power of Vector Quantization for Multi-Species Genomic Sequence Modeling

Siyuan Li, Zedong Wang, Zicheng Liu +5

Similar to natural language models, pre-trained genome language models are proposed to capture the underlying intricacies within genomes with unsupervised sequence modeling. They h…

q-bio.BM2024★ 7 cited

Advances of Deep Learning in Protein Science: A Comprehensive Survey

Bozhen Hu, Cheng Tan, Lirong Wu +7

Protein representation learning plays a crucial role in understanding the structure and function of proteins, which are essential biomolecules involved in various biological proces…

cs.LG2024

Graph-level Protein Representation Learning by Structure Knowledge Refinement

Ge Wang, Zelin Zang, Jiangbin Zheng +2

This paper focuses on learning representation on the whole graph level in an unsupervised manner. Learning graph-level representation plays an important role in a variety of real-w…

cs.AI2023

Progressive Multi-Modality Learning for Inverse Protein Folding

Jiangbin Zheng, Stan Z. Li

While deep generative models show promise for learning inverse protein folding directly from data, the lack of publicly available structure-sequence pairings limits their generaliz…

cs.LG2023★ 1 cited

Protein 3D Graph Structure Learning for Robust Structure-based Protein Property Prediction

Yufei Huang, Siyuan Li, Jin Su +9

Protein structure-based property prediction has emerged as a promising approach for various biological tasks, such as protein function prediction and sub-cellular location estimati…

cs.LG2023★ 1 cited

Co-modeling the Sequential and Graphical Routes for Peptide Representation Learning

Zihan Liu, Ge Wang, Jiaqi Wang +2

Peptides are formed by the dehydration condensation of multiple amino acids. The primary structure of a peptide can be represented either as an amino acid sequence or as a molecula…

q-bio.BM2022

Deciphering RNA Secondary Structure Prediction: A Probabilistic K-Rook Matching Perspective

Cheng Tan, Zhangyang Gao, Hanqun Cao +6

The secondary structure of ribonucleic acid (RNA) is more stable and accessible in the cell than its tertiary structure, making it essential for functional prediction. Although dee…