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Quality assessment of RNA 3D structure models using deep learning and intermediate 2D maps
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  • Published: 21 January 2026

Quality assessment of RNA 3D structure models using deep learning and intermediate 2D maps

  • Xiaocheng Liu  ORCID: orcid.org/0009-0004-1744-182X1 na1,
  • Wenkai Wang  ORCID: orcid.org/0000-0001-8603-82501 na1,
  • Zongyang Du2,3,
  • Ziyi Wang1,
  • Zhenling Peng  ORCID: orcid.org/0000-0003-0303-66931 &
  • …
  • Jianyi Yang  ORCID: orcid.org/0000-0003-2912-77371 

Communications Biology , Article number:  (2026) Cite this article

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We are providing an unedited version of this manuscript to give early access to its findings. Before final publication, the manuscript will undergo further editing. Please note there may be errors present which affect the content, and all legal disclaimers apply.

Subjects

  • Computational models
  • Non-coding RNAs
  • Protein structure predictions

Abstract

Accurate quality assessment is critical for computational prediction and design of RNA three-dimensional (3D) structures, yet it remains a significant challenge. In this work, we introduce RNArank, a deep learning-based approach to both local and global quality assessment of predicted RNA 3D structure models. For a given structure model, RNArank extracts a comprehensive set of multi-modal features and processes them with a Y-shaped residual neural network. This network is trained to predict two intermediate 2D maps, including the inter-nucleotide contact map and the distance deviation map. These maps are then used to estimate the local and global accuracy. Extensive benchmark tests indicate that RNArank consistently outperforms traditional methods and other deep learning-based methods. Moreover, RNArank demonstrates promising performance in identifying high-quality structure models for targets from the recent CASP15 and CASP16 experiments. We anticipate that RNArank will serve as a valuable tool for the RNA biology community, improving the reliability of RNA structure modeling and thereby contributing to a deeper understanding of RNA function.

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Data availability

The authors declare that the data supporting the results and conclusions of this study are available within the paper and its Supplementary Information. The source data underlying Figs. 2–4 are provided in the Supplementary Data file. The test source data used in this study is available at Zenodo48 and our website (https://yanglab.qd.sdu.edu.cn/RNArank/benchmark/).

Code availability

The RNArank web server is available at: https://yanglab.qd.sdu.edu.cn/RNArank/. The source codes are available at Zenodo48 and GitHub (https://github.com/YangLab-SDU/RNArank/).

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Acknowledgements

This work is supported by the following funding sources: National Natural Science Foundation of China (NSFC T2225007, T2222012, 32430063, 62402075, 62501364), Postdoctoral Fellowship Program and China Postdoctoral Science Foundation (BX20240212, 2025M783122), the Science and Technology Research Program of Chongqing Municipal Education Commission (KJQN202300639), and Fundamental Research Funds for the Central Universities.

Author information

Author notes
  1. These authors contributed equally: Xiaocheng Liu, Wenkai Wang.

Authors and Affiliations

  1. MOE Frontiers Science Center for Nonlinear Expectations, State Key Laboratory of Cryptography and Digital Economy Security, Research Center for Mathematics and Interdisciplinary Sciences, Shandong University, Qingdao, China

    Xiaocheng Liu, Wenkai Wang, Ziyi Wang, Zhenling Peng & Jianyi Yang

  2. Chongqing Key Laboratory of Big Data for Bio Intelligence, Chongqing University of Posts and Telecommunications, Chongqing, China

    Zongyang Du

  3. Department of Biomedical Engineering, Chongqing University of Posts and Telecommunications, Chongqing, China

    Zongyang Du

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Contributions

J.Y. conceptualized and administered the study. X.L. designed and implemented the network. X.L., W.W., and J.Y. conducted the formal analysis. X.L., W.W., Z.D., and Z.W. performed data curation and generated decoys. Z.P. and W.W. co-supervised the study. All authors wrote and revised the manuscript.

Corresponding authors

Correspondence to Wenkai Wang or Jianyi Yang.

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The authors declare no competing interests.

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Communications Biology thanks the anonymous reviewers for their contribution to the peer review of this work. Primary Handling Editors: Xiangtao Li and Laura Rodríguez Pérez.

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Cite this article

Liu, X., Wang, W., Du, Z. et al. Quality assessment of RNA 3D structure models using deep learning and intermediate 2D maps. Commun Biol (2026). https://doi.org/10.1038/s42003-026-09582-2

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  • Received: 07 August 2025

  • Accepted: 12 January 2026

  • Published: 21 January 2026

  • DOI: https://doi.org/10.1038/s42003-026-09582-2

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