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基于串联质谱的快速肽段鉴定算法
引用本文:邵明芝,徐云,王颖,李文军.基于串联质谱的快速肽段鉴定算法[J].计算机工程,2010,36(18):214-216.
作者姓名:邵明芝  徐云  王颖  李文军
作者单位:中国科学技术大学计算机科学技术系,合肥,230026;安徽省高性能计算重点实验室,合肥,230026
基金项目:国家自然科学基金资助重点项目 
摘    要:在现有RT-PSM算法的基础上,完成蛋白质数据库酶切成肽段数据库的转换过程,提出有效峰提取的优化策略,设计一个肽段鉴定算法——FPI-PSM。对于没有翻译后修饰的情形,采用Keller数据集进行测试。与RT-PSM算法相比,FPI-PSM算法的灵敏度提高了5%,每个质谱的平均鉴定时间从13.6 ms下降到5.6 ms。

关 键 词:串联质谱  肽段鉴定  碎片离子  有效峰提取

Fast Peptide Identification Algorithm Based on Tandem Mass Spectrum
SHAO Ming-zhi,XU Yun,WANG Ying,LI Wen-jun.Fast Peptide Identification Algorithm Based on Tandem Mass Spectrum[J].Computer Engineering,2010,36(18):214-216.
Authors:SHAO Ming-zhi  XU Yun  WANG Ying  LI Wen-jun
Affiliation:(1. Department of Computer Science and Technology, University of Science and Technology of China, Hefei 230026, China; 2. Anhui Province Key Laboratory of High Performance Computing, Hefei 230026, China)
Abstract:Based on existing RT-PSM algorithm, this paper proposes a new peptide identification algorithm called FPI-PSM, which transforms the digestion of protein into peptide database and proposes an optimization strategy for effective peak extraction. Ignoring post-translational modification, it conducts tests on the recognized Keller dataset. Compared to RT-PSM, FPI-PSM improves the sensitivity by 5%, and decreases the average time of identifying each mass spectra from 13.6 ms to 5.6 ms.
Keywords:tandem mass spectrum  peptide identification  fragmentions  effective peak extraction
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