Qianli Meng, Ying Cui, Min Zhang, Lixin Zhang, Liang Zhang, Jinxin Zhang, Jian Kuang, Qingyang Liu, Yang Zheng, Zhongling Luo, Huikun Liu, Guoping Zhu, Jingjing Cai, Guanrong Zhang, Xingxuan Wen, Haike Guo
Design and baseline characteristics of a population-based study of eye disease in southern Chinese people: the Dongguan Eye Study
Clinical & experimental ophthalmology
present automated method maps surface reaction pathways experimental data minimal human interventions method bias potentials promoting surface reactions applied enable statistical samplings surface reaction within timescale ab initio molecular dynamics md simulations elementary reactions extracted automatically using extension method constructed gas liquidphase reactions converting extracted elementary reaction data directed graph data md trajectories efficiently mapped onto reaction pathways using network analysis tool demonstrate power method applied steam reforming methane rh111 surface propane reforming pt111 pt3sn111 surfaces discover new energetically favorable pathways reactions reproduce experimentallyobserved materialsdependence surface reaction activity selectivity propane reforming reactions