生物
对接(动物)
漏斗
Web服务器
计算生物学
生物系统
蛋白质结构
蛋白质-蛋白质相互作用
水准点(测量)
生物信息学
计算机科学
遗传学
生物化学
互联网
操作系统
医学
护理部
有机化学
化学
大地测量学
地理
作者
Sergey Lyskov,Jeffrey J. Gray
摘要
The RosettaDock server (http://rosettadock.graylab.jhu.edu) identifies low-energy conformations of a protein-protein interaction near a given starting configuration by optimizing rigid-body orientation and side-chain conformations. The server requires two protein structures as inputs and a starting location for the search. RosettaDock generates 1000 independent structures, and the server returns pictures, coordinate files and detailed scoring information for the 10 top-scoring models. A plot of the total energy of each of the 1000 models created shows the presence or absence of an energetic binding funnel. RosettaDock has been validated on the docking benchmark set and through the Critical Assessment of PRedicted Interactions blind prediction challenge.
科研通智能强力驱动
Strongly Powered by AbleSci AI