Journal of Applied Crystallography最新文献_第7页

Laueprocess: a software package for processing Laue diffraction data Laueprocess：用于处理Laue衍射数据的软件包

IF 2.8 3区材料科学

Journal of Applied Crystallography Pub Date : 2025-07-02 DOI: 10.1107/S1600576725005023

Zhijun Wang, Cheng Pan, Li Yu, Bingchen He, Zhenhuang Su, Weizhe Zhang, Sisheng Wang, Bo Sun, Wen Wen, Xingyu Gao, Quan Hao

{"title":"Laueprocess: a software package for processing Laue diffraction data","authors":"Zhijun Wang, Cheng Pan, Li Yu, Bingchen He, Zhenhuang Su, Weizhe Zhang, Sisheng Wang, Bo Sun, Wen Wen, Xingyu Gao, Quan Hao","doi":"10.1107/S1600576725005023","DOIUrl":"https://doi.org/10.1107/S1600576725005023","url":null,"abstract":"With the development of fourth-generation synchrotron radiation sources, generating monochromatic beams from white beams for conventional rotation-based diffraction experiments at 100 K would involve discarding significantly more photons to avoid radiation damage to protein crystals than was necessary for third-generation synchrotron radiation sources. This makes single-pulse Laue diffraction investigations more attractive. However, evaluating polychromatic diffraction data is more complicated than using monochromatic diffraction data. To address this problem, a software package, Laueprocess, was developed to process Laue diffraction data at the Shanghai Synchrotron Radiation Facility. It is a graphical user interface program, based on the MATLAB programming language. Laueprocess has been applied to process Laue diffraction data from the fields of protein crystallography, small-molecule crystallography and materials science. It reduces the complexity of data processing and can be used to automatically process data from materials science. Laueprocess has been applied at the BL03HB beamline to process Laue diffraction datasets in manual and automated pipelines.","PeriodicalId":48737,"journal":{"name":"Journal of Applied Crystallography","volume":"58 4","pages":"1496-1510"},"PeriodicalIF":2.8,"publicationDate":"2025-07-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"144773729","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":3,"RegionCategory":"材料科学","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}