Petoukhov Maxim V, Franke Daniel, Shkumatov Alexander V, Tria Giancarlo, Kikhney Alexey G, Gajda Michal, Gorba Christian, Mertens Haydyn D T, Konarev Petr V, Svergun Dmitri I
European Molecular Biology Laboratory, Hamburg Unit, EMBL c/o DESY, Notkestrasse 85, Hamburg 22607, Germany.
J Appl Crystallogr. 2012 Mar 15;45(Pt 2):342-350. doi: 10.1107/S0021889812007662. eCollection 2012 Apr 1.
New developments in the program package (version 2.4) for the processing and analysis of isotropic small-angle X-ray and neutron scattering data are described. They include (i) multiplatform data manipulation and display tools, (ii) programs for automated data processing and calculation of overall parameters, (iii) improved usage of high- and low-resolution models from other structural methods, (iv) new algorithms to build three-dimensional models from weakly interacting oligomeric systems and complexes, and (v) enhanced tools to analyse data from mixtures and flexible systems. The new release includes installers for current major platforms (Windows, Linux and Mac OSX) and provides improved indexed user documentation. The web-related developments, including a user discussion forum and a widened online access to run programs, are also presented.
介绍了用于处理和分析各向同性小角X射线和中子散射数据的程序包(版本2.4)的新进展。这些进展包括:(i)多平台数据处理和显示工具;(ii)自动数据处理和整体参数计算程序;(iii)更好地利用其他结构方法的高分辨率和低分辨率模型;(iv)从弱相互作用的寡聚体系和复合物构建三维模型的新算法;(v)增强的用于分析混合物和柔性体系数据的工具。新版本包括针对当前主要平台(Windows、Linux和Mac OSX)的安装程序,并提供了改进的索引用户文档。还介绍了与网络相关的进展,包括用户讨论论坛和更广泛的在线程序运行访问权限。