Grant Barry J, Rodrigues Ana P C, ElSawy Karim M, McCammon J Andrew, Caves Leo S D
Department of Chemistry and Biochemistry, University of California, San Diego La Jolla, CA 92093, USA.
Bioinformatics. 2006 Nov 1;22(21):2695-6. doi: 10.1093/bioinformatics/btl461. Epub 2006 Aug 29.
An automated procedure for the analysis of homologous protein structures has been developed. The method facilitates the characterization of internal conformational differences and inter-conformer relationships and provides a framework for the analysis of protein structural evolution. The method is implemented in bio3d, an R package for the exploratory analysis of structure and sequence data.
The bio3d package is distributed with full source code as a platform-independent R package under a GPL2 license from: http://mccammon.ucsd.edu/~bgrant/bio3d/
已开发出一种用于分析同源蛋白质结构的自动化程序。该方法有助于表征内部构象差异和构象异构体之间的关系,并为蛋白质结构进化分析提供了一个框架。该方法在bio3d中实现,bio3d是一个用于结构和序列数据探索性分析的R包。
bio3d包以独立于平台的R包形式,在GPL2许可下随完整源代码一起分发,可从以下网址获取:http://mccammon.ucsd.edu/~bgrant/bio3d/