BioXTAS RAW: improvements to a free open-source program for small-angle X-ray scattering data reduction and analysis.
BioXTAS RAW: improvements to a free open-source program for small-angle X-ray scattering data reduction and analysis.
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DOI：
10.1107/s1600576717011438
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发表时间：
2017-10-01
影响因子：
6.1
通讯作者：
Skou S
中科院分区：
文献类型：
--
作者：
Hopkins JB;Gillilan RE;Skou S
BioXTAS RAW是一个基于图形用户界面的免费开源Python程序，用于简化和分析小角X射线溶液散射（SAXS）数据，包括尺寸排阻色谱耦合SAXS数据。该软件专为生物数据而设计，能够根据二维检测器图像创建和绘制一维散射分布图，进行标准数据操作，如平均和减法以及回转半径和分子量分析，以及更高级的分析，如逆傅立叶变换计算。 BioXTAS RAW是一个基于图形用户界面的免费开源Python程序，用于减少和分析小角度X射线溶液散射（SAXS）数据。该软件专为生物SAXS数据而设计，能够从二维检测器图像创建和绘制一维散射轮廓，进行标准数据操作，如平均和减法以及回转半径和分子量分析，以及进行高级分析，如逆傅立叶变换和包络计算。它还允许容易地处理在线尺寸排阻色谱耦合SAXS数据和数据去卷积使用的演变因子分析方法。它提供了一种替代封闭源程序，如Primus和Screwtter的原始数据分析。因为它可以校准，掩模和集成图像，它还提供了一种替代同步加速器光束线管道，科学家可以安装在自己的计算机上，并在家里和光束线上使用。
BioXTAS RAW is a graphical-user-interface-based free open-source Python program for reduction and analysis of small-angle X-ray solution scattering (SAXS) data, including size-exclusion chromatography coupled SAXS data. The software is designed for biological data and enables creation and plotting of one-dimensional scattering profiles from two-dimensional detector images, standard data operations such as averaging and subtraction and analysis of radius of gyration and molecular weight, and more advanced analyses such as calculation of inverse Fourier transforms. BioXTAS RAW is a graphical-user-interface-based free open-source Python program for reduction and analysis of small-angle X-ray solution scattering (SAXS) data. The software is designed for biological SAXS data and enables creation and plotting of one-dimensional scattering profiles from two-dimensional detector images, standard data operations such as averaging and subtraction and analysis of radius of gyration and molecular weight, and advanced analysis such as calculation of inverse Fourier transforms and envelopes. It also allows easy processing of inline size-exclusion chromatography coupled SAXS data and data deconvolution using the evolving factor analysis method. It provides an alternative to closed-source programs such as Primus and ScÅtter for primary data analysis. Because it can calibrate, mask and integrate images it also provides an alternative to synchrotron beamline pipelines that scientists can install on their own computers and use both at home and at the beamline.