Macromolecules Structural Classification With a 3D Dilated Dense Network in Cryo-Electron Tomography.

Journal: IEEE/ACM transactions on computational biology and bioinformatics
Published Date:

Abstract

Cryo-electron tomography, combined with subtomogram averaging (STA), can reveal three-dimensional (3D) macromolecule structures in the near-native state from cells and other biological samples. In STA, to get a high-resolution 3D view of macromolecule structures, diverse macromolecules captured by the cellular tomograms need to be accurately classified. However, due to the poor signal-to-noise-ratio (SNR) and severe ray artifacts in the tomogram, it remains a major challenge to classify macromolecules with high accuracy. In this paper, we propose a new convolutional neural network, named 3D-Dilated-DenseNet, to improve the performance of macromolecule classification. In 3D-Dilated-DenseNet, there are two key strategies to guarantee macromolecule classification accuracy: 1) Using dense connections to enhance feature map utilization (corresponding to the baseline 3D-C-DenseNet); 2) Adopting dilated convolution to enrich multi-level information in feature maps. We tested 3D-Dilated-DenseNet and 3D-C-DenseNet both on synthetic data and experimental data. The results show that, on synthetic data, compared with the state-of-the-art method in the SHREC contest (SHREC-CNN), both 3D-C-DenseNet and 3D-Dilated-DenseNet outperform SHREC-CNN. In particular, 3D-Dilated-DenseNet improves 0.393 of F1 metric on tiny-size macromolecules and 0.213 on small-size macromolecules. On experimental data, compared with 3D-C-DenseNet, 3D-Dilated-DenseNet can increase classification performance by 2.1 percent.

Authors

  • Shan Gao
    Department of Mathematics and Statistics, Yunnan University, China.
  • Renmin Han
    King Abdullah University of Science and Technology (KAUST), Computational Bioscience Research Center (CBRC), Computer, Electrical and Mathematical Sciences and Engineering (CEMSE) Division, Thuwal, Saudi Arabia.
  • Xiangrui Zeng
    Computational Biology Department, School of Computer Science, Carnegie Mellon University, Pittsburgh 15213, USA.
  • Zhiyong Liu
    State Key Laboratory of Respiratory Disease , Guangzhou Institutes of Biomedicine and Health (GIBH) , Chinese Academy of Sciences (CAS) , Guangzhou-510530 , China . Email: zhang_tianyu@gibh.ac.cn ; ; Tel: (+86)20 3201 5270.
  • Min Xu
    Department of Gastroenterology, Shanghai First People's Hospital, School of Medicine, Shanghai Jiao Tong University, Shanghai, People's Republic of China.
  • Fa Zhang
    High Performance Computer Research Center, Institute of Computing Technology, Chinese Academy of Sciences, Beijing, China.