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The Journal of Chemical Physics|August 3, 2017
Path lumping: An efficient algorithm to identify metastable path channels for conformational dynamics of multi-body systemsLuming Meng, Fu Kit Sheong, Xiangze Zeng, et al.Journal of Computational Chemistry|November 22, 2016
Adaptive partitioning by local density-peaks: An efficient density-based clustering algorithm for analyzing molecular dynamics trajectoriesSong Liu, Lizhe Zhu, Fu Kit Sheong, et al.The Journal of Chemical Physics|August 24, 2018
An efficient Bayesian kinetic lumping algorithm to identify metastable conformational states via Gibbs samplingWei Wang, Tong Liang, Fu Kit Sheong, et al.Advances in Experimental Medicine and Biology|January 22, 2014
Application of Markov State Models to simulate long timescale dynamics of biological macromoleculesLin-Tai Da, Fu Kit Sheong, Daniel-Adriano Silva, et al.Journal of Computational Chemistry|September 22, 2012
A fast parallel clustering algorithm for molecular simulation trajectoriesYutong Zhao, Fu Kit Sheong, Jian Sun, et al.Journal of Chemical Theory and Computation|November 18, 2015
Automatic state partitioning for multibody systems (APM): an efficient algorithm for constructing Markov state models to elucidate conformational dynamics of multibody systemsFu Kit Sheong, Daniel-Adriano Silva, Luming Meng, et al.Plos Computational Biology|July 17, 2015
Markov State Models Reveal a Two-Step Mechanism of miRNA Loading into the Human Argonaute Protein: Selective Binding followed by Structural Re-arrangementHanlun Jiang, Fu Kit Sheong, Lizhe Zhu, et al.RSC Advances|May 11, 2022
Isolation and enantiostability of the B-chiral bis(salicylato)borate anions [B <sub></sub> (Sal)<sub>2</sub>] and [B <sub></sub> (Sal)<sub>2</sub>]Lawrence W-Y Wong, Alex S-F Au Yeung, Gemma S-S Tam, et al.The Journal of Chemical Physics|April 1, 2019
TAPS: A traveling-salesman based automated path searching method for functional conformational changes of biological macromoleculesLizhe Zhu, Fu Kit Sheong, Siqin Cao, et al.Progress in Biophysics and Molecular Biology|October 5, 2016
Understanding the core of RNA interference: The dynamic aspects of Argonaute-mediated processesLizhe Zhu, Hanlun Jiang, Fu Kit Sheong, et al.Pageof 77