{"title":"基于几何感知的低温电子层析图模板匹配","authors":"Raffaele Coray, Daniel Castaño-Díez","doi":"10.1016/j.str.2025.06.009","DOIUrl":null,"url":null,"abstract":"Template matching has a long history of serving as a tool for the automated analysis of volumes in cryo-electron tomography (cryo-ET). Recent theoretical and computational studies of the technique have pinpointed the importance of using fine angular samplings and high resolution scans to attain meaningful results, thus highlighting the necessity of approaches that alleviate the computational burden inherent to this technique. We present the new module for model-aware template matching in <em>Dynamo</em>, an open-source tool that allows the integration of possibly available <em>a priori</em> information in the set-up of a template matching computation, leading—in favorable cases—to large computational gains, as the scanning effort can be more efficiently restricted to relevant spatial positions and dynamically defined angular orientations. This approach has been successfully tested on a representative range of sample geometries typically arising in tomography, modeling particles distributed over tubular, membranous, or vesicular structures.","PeriodicalId":22168,"journal":{"name":"Structure","volume":"2 1","pages":""},"PeriodicalIF":4.3000,"publicationDate":"2025-07-17","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":"0","resultStr":"{\"title\":\"Geometry-aware template matching for cryo-electron tomograms in Dynamo\",\"authors\":\"Raffaele Coray, Daniel Castaño-Díez\",\"doi\":\"10.1016/j.str.2025.06.009\",\"DOIUrl\":null,\"url\":null,\"abstract\":\"Template matching has a long history of serving as a tool for the automated analysis of volumes in cryo-electron tomography (cryo-ET). Recent theoretical and computational studies of the technique have pinpointed the importance of using fine angular samplings and high resolution scans to attain meaningful results, thus highlighting the necessity of approaches that alleviate the computational burden inherent to this technique. We present the new module for model-aware template matching in <em>Dynamo</em>, an open-source tool that allows the integration of possibly available <em>a priori</em> information in the set-up of a template matching computation, leading—in favorable cases—to large computational gains, as the scanning effort can be more efficiently restricted to relevant spatial positions and dynamically defined angular orientations. This approach has been successfully tested on a representative range of sample geometries typically arising in tomography, modeling particles distributed over tubular, membranous, or vesicular structures.\",\"PeriodicalId\":22168,\"journal\":{\"name\":\"Structure\",\"volume\":\"2 1\",\"pages\":\"\"},\"PeriodicalIF\":4.3000,\"publicationDate\":\"2025-07-17\",\"publicationTypes\":\"Journal Article\",\"fieldsOfStudy\":null,\"isOpenAccess\":false,\"openAccessPdf\":\"\",\"citationCount\":\"0\",\"resultStr\":null,\"platform\":\"Semanticscholar\",\"paperid\":null,\"PeriodicalName\":\"Structure\",\"FirstCategoryId\":\"99\",\"ListUrlMain\":\"https://doi.org/10.1016/j.str.2025.06.009\",\"RegionNum\":2,\"RegionCategory\":\"生物学\",\"ArticlePicture\":[],\"TitleCN\":null,\"AbstractTextCN\":null,\"PMCID\":null,\"EPubDate\":\"\",\"PubModel\":\"\",\"JCR\":\"Q2\",\"JCRName\":\"BIOCHEMISTRY & MOLECULAR BIOLOGY\",\"Score\":null,\"Total\":0}","platform":"Semanticscholar","paperid":null,"PeriodicalName":"Structure","FirstCategoryId":"99","ListUrlMain":"https://doi.org/10.1016/j.str.2025.06.009","RegionNum":2,"RegionCategory":"生物学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":null,"EPubDate":"","PubModel":"","JCR":"Q2","JCRName":"BIOCHEMISTRY & MOLECULAR BIOLOGY","Score":null,"Total":0}
Geometry-aware template matching for cryo-electron tomograms in Dynamo
Template matching has a long history of serving as a tool for the automated analysis of volumes in cryo-electron tomography (cryo-ET). Recent theoretical and computational studies of the technique have pinpointed the importance of using fine angular samplings and high resolution scans to attain meaningful results, thus highlighting the necessity of approaches that alleviate the computational burden inherent to this technique. We present the new module for model-aware template matching in Dynamo, an open-source tool that allows the integration of possibly available a priori information in the set-up of a template matching computation, leading—in favorable cases—to large computational gains, as the scanning effort can be more efficiently restricted to relevant spatial positions and dynamically defined angular orientations. This approach has been successfully tested on a representative range of sample geometries typically arising in tomography, modeling particles distributed over tubular, membranous, or vesicular structures.
期刊介绍:
Structure aims to publish papers of exceptional interest in the field of structural biology. The journal strives to be essential reading for structural biologists, as well as biologists and biochemists that are interested in macromolecular structure and function. Structure strongly encourages the submission of manuscripts that present structural and molecular insights into biological function and mechanism. Other reports that address fundamental questions in structural biology, such as structure-based examinations of protein evolution, folding, and/or design, will also be considered. We will consider the application of any method, experimental or computational, at high or low resolution, to conduct structural investigations, as long as the method is appropriate for the biological, functional, and mechanistic question(s) being addressed. Likewise, reports describing single-molecule analysis of biological mechanisms are welcome.
In general, the editors encourage submission of experimental structural studies that are enriched by an analysis of structure-activity relationships and will not consider studies that solely report structural information unless the structure or analysis is of exceptional and broad interest. Studies reporting only homology models, de novo models, or molecular dynamics simulations are also discouraged unless the models are informed by or validated by novel experimental data; rationalization of a large body of existing experimental evidence and making testable predictions based on a model or simulation is often not considered sufficient.