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20212026
most citedDiffPack: A Torsional Diffusion Model for Autoregressive Protein Side-Chain Packing

16 citations · 60 across the 15 of their papers we have counts for

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Showing 2024Show all

5 papers · 1 filter

cs.LG2024

ReactZyme: A Benchmark for Enzyme-Reaction Prediction

Chenqing Hua, Bozitao Zhong, Sitao Luan +4

Enzymes, with their specific catalyzed reactions, are necessary for all aspects of life, enabling diverse biological processes and adaptations. Predicting enzyme functions is essen…

q-bio.QM2024★ 3 cited

Autoregressive Enzyme Function Prediction with Multi-scale Multi-modality Fusion

Dingyi Rong, Wenzhuo Zheng, Bozitao Zhong +3

Accurate prediction of enzyme function is crucial for elucidating biological mechanisms and driving innovation across various sectors. Existing deep learning methods tend to rely s…

q-bio.QM2024★ 1 cited

Protein Representation Learning with Sequence Information Embedding: Does it Always Lead to a Better Performance?

Yang Tan, Lirong Zheng, Bozitao Zhong +2

Deep learning has become a crucial tool in studying proteins. While the significance of modeling protein structure has been discussed extensively in the literature, amino acid type…

cs.CL2024

Simple, Efficient and Scalable Structure-aware Adapter Boosts Protein Language Models

Yang Tan, Mingchen Li, Bingxin Zhou +7

Fine-tuning Pre-trained protein language models (PLMs) has emerged as a prominent strategy for enhancing downstream prediction tasks, often outperforming traditional supervised lea…

q-bio.BM2024

Fusing Neural and Physical: Augment Protein Conformation Sampling with Tractable Simulations

Jiarui Lu, Zuobai Zhang, Bozitao Zhong +2

The protein dynamics are common and important for their biological functions and properties, the study of which usually involves time-consuming molecular dynamics (MD) simulations…