分子场快速计算及在蛋白质识别研究中的应用.pdfVIP

ISSN 1673-9418 CODEN JKYTA8 E-mail: fcst@vip. 163.com Journal of Frontiers of Computer Science and Technology 1673-9418/2013/07(03)-0227-09 Tel: +86-10 doi: 10.3778/j.issn. 1673-9418.1208014 分子场快速计算及在蛋白质识别研究中的应用* 1,2,3 2+ 1 2 张 繁 ，王章野 ，吴 韬 ，彭群生 1. 浙江大学 软物质科学研究中心，杭州 310007 2. 浙江大学 CADCG 国家重点实验室，杭州 310007 3. 浙江工业大学 计算机科学与技术学院，杭州 310023 Fast Calculation of Protein Molecular Field and Its Application on Protein Recog- nition Research 1,2,3 2+ 1 2 ZHANG Fan , WANG Zhangye , WU Tao , PENG Qunsheng 1. Research Center of Soft Matter, Zhejiang University, Hangzhou 310007, China 2. State Key Lab of CADCG, Zhejiang University, Hangzhou 310007, China 3. College of Computer Science and Technology, Zhejiang University of Technology, Hangzhou 310023, China + Corresponding author: E-mail: zywang@ ZHANG Fan, WANG Zhangye, WU Tao, et al. Fast calculation of protein molecular field and its application on protein recognition research. Journal of Frontiers of Computer Science and Technology, 2013, 7(3) ：227-235. Abstract: It has been found that key area research during protein recognition process is typically important for proclaiming biological phenomena essence, improving drug design efficiency and decreasing cost and shortening industrial cycle of new drug design. For high complexity of protein macromolecule structure, common computer systems are not capable for continuously tracking coherence change of structure and function during protein recognition. This paper sets up a he