x射线衍射(XRD)

DIFFRAC。一枝

DIFFRAC。一枝is a comprehensive software suite for analyzing Small Angle X-Ray Scattering (SAXS) data including visualization, pre-processing, and subsequent evaluation and analysis.

Основныемоменты

分析SAXS数据的全包软件套件

使用DIFFRAC。一枝, interpretation of 1D and 2D SAXS data has never been easier, faster, and more accurate. It combines an extensive collection of modern and powerful algorithms for data processing and evaluation with a workflow that is simple and flexible. Seamless integration of each step in the visualization, data reduction and analysis process ensure ease of use and accurate results.

  • 导入和可视化
  • 数据预处理
  • SAXS具体的图和评价
  • 缩放到绝对单位和分子量计算
  • 基于模型的拟合
  • 对距离分布函数(pddf)
  • 数据交换和报告

Особенности

导入和可视化

DIFFRAC。一枝displays 1D and 2D SAXS data, as well as Nanography maps. Supported data formats are brml, raw, ascii (two-column xy and three-column xye with different units), gfrm and tiff.

数据预处理

DIFFRAC。一枝allows extracting the pure scattering signal of the nanostructures straightaway.

在第一步中,用玻璃碳作为参考或基于一次光束强度比来确定样品透射率。随后,通过优化算法将二维数据切片或集成到一维数据中,以便进一步评估。
DIFFRAC。一枝can perform both the transmission calculation and the background correction automatically, without the need for user intervention, if the data measurement strategy is set up with DIFFRAC.WIZARD.

SAXS具体的图和评价

传统上,SAXS曲线显示为具有特定轴刻度的图,允许对数据质量进行快速图形化检查,并直接进行参数评估,如Guinier、Porod和Kratky图。在DIFFRAC。一枝all plot types can be readily selected by name. Evaluation of the related parameters, such the radius of gyration (Rg), the forward scattered intensity, the Porod scattering invariant, surface-to-volume ratio etc. is done fully automatically or interactively in a step-by-step procedure.

基于模型的拟合

DIFFRAC。一枝features a non-linear least-squares fitting of 1D SAXS data based on direct modeling of nanostructures in solution using geometrical shapes (sphere, cylinder, etc.) or by dedicated polymer models (chains, Gaussian star, etc.). It also takes into account polydispersity and concentration effects for complete sample characterization. The corresponding model parameters are determined by fitting the experimental SAXS curve.

对距离分布函数

对距离分布函数(PDDF) p(r)是散射粒子内任意两点之间的距离分布。PDDF是粒子大小和形状的函数,并通过正弦傅里叶变换与散射曲线相关。

Спецификации

DIFFRAC。一枝Specifications

版本

该软件的当前版本是DIFFRAC。一枝V1.0。

分析方法

交互式和自动吉尼尔分析,提供旋转半径,向前散射强度等。

交互式或自动Porod分析,提供Porod散射不变量,表面体积比等。

Kratky分析

蛋白质的分子量,按绝对单位换算

对距离分布函数(PDDF)

考虑多分散性和相互作用效应的纳米颗粒形状模型的一维SAXS数据非线性最小二乘拟合

操作系统

  • Windows 7、8和10
  • 32位和64位

Поддержка

保持你的DIFFRAC。萨克斯是最新的

免费维护更新

自由DIFFRAC。一枝Maintenance Update renews your SAXS version to the most recent release. Regardless of your SAXS license level, you can always download the latest Maintenance Update from www.brukersupport.com, free of charge!

下载过程

修正

保持你的dirac。萨克斯是最新的, you will benefit from all bugfixes made for the current but also all previously released versions, regardless of the license level. DIFFRAC.SAXS Maintenance Updates are cumulative and can therefore be applied to any previous version.

升级是什么?

DIFFRAC。一枝Maintenance Updates do not come with new features. If you want to benefit from features introduced in new major releases you need to purchase the latest DIFFRAC.SAXS upgrade.