Scientific Computing Department, Science and Technology Facilities Council, Research Complex at Harwell, Didcot OX11 0FA, United Kingdom.
Section for Structural and Synthetic Biology, Department of Infectious Disease, Imperial College London, Imperial College Road, South Kensington, London SW7 2AZ, United Kingdom.
Acta Crystallogr D Struct Biol. 2022 Feb 1;78(Pt 2):136-143. doi: 10.1107/S2059798321012286. Epub 2022 Jan 25.
Cryo-EM images have extremely low signal-to-noise levels because biological macromolecules are highly radiation-sensitive, requiring low-dose imaging, and because the molecules are poor in contrast. Confident recovery of the signal requires the averaging of many images, the iterative optimization of parameters and the introduction of much prior information. Poor parameter estimates, overfitting and variations in signal strength and resolution across the resulting reconstructions remain frequent issues. Because biological samples are real-space phenomena, exhibiting local variations, real-space measures can be both more reliable and more appropriate than Fourier-space measures. Real-space measures can be calculated separately over each differing region of an image or volume. Real-space filters can be applied according to the local need. Powerful prior information, not available in Fourier space, can be introduced in real space. Priors can be applied in real space in ways that Fourier space precludes. The treatment of biological phenomena remains highly dependent on spatial frequency, however, which would normally be handled in Fourier space. We believe that measures and filters based around real-space operations on extracted frequency bands, i.e. a series of band-pass filtered real-space volumes, and over real-space densities of striding (sequentially increasing or decreasing) resolution through Fourier space are the best way to address this and will perform better than global Fourier-space-based approaches. Future developments in image processing within the field are generally expected to be based on a mixture of both rationally designed and deep-learning approaches, and to incorporate novel prior information from developments such as AlphaFold. Regardless of approach, it is clear that `locality', through real-space measures, filters and processing, will become central to image processing.
冷冻电镜图像的信噪比较低,因为生物大分子对辐射非常敏感,需要低剂量成像,而且分子对比度差。要可靠地恢复信号,需要对许多图像进行平均,对参数进行迭代优化,并引入大量先验信息。参数估计不佳、过度拟合以及重建中信号强度和分辨率的变化仍然是常见的问题。由于生物样本是实空间现象,存在局部变化,因此实空间测量既更可靠,也更合适,比傅里叶空间测量更合适。可以分别在图像或体积的每个不同区域计算实空间测量值。可以根据局部需要应用实空间滤波器。可以在实空间中引入傅里叶空间中不可用的强大先验信息。可以以傅里叶空间不允许的方式在实空间中应用先验信息。然而,对生物现象的处理仍然高度依赖于空间频率,这通常在傅里叶空间中处理。我们认为,基于提取的频带(即一系列带通滤波的实空间体积)上的实空间操作的测量值和滤波器,以及通过傅里叶空间对实空间密度进行跨越(逐步增加或减少)分辨率的方法,是解决此问题的最佳方法,并且比基于全局傅里叶空间的方法表现更好。该领域的图像处理的未来发展通常预计将基于理性设计和深度学习方法的混合,并结合来自 AlphaFold 等发展的新的先验信息。无论采用何种方法,显然通过实空间测量值、滤波器和处理实现的“局部性”将成为图像处理的核心。