CATBOSS: Cluster Analysis of Trajectories Based on Segment Splitting. - Jovan Damjanovic; James M. Murphy; Yu-Shan Lin (J. Chem. Inf. Model., 2021)

Computational Prediction of Cyclic Peptide Structural Ensembles and Application to the Design of Keap1 Binders. - Francini Fonseca Lopez; Jiayuan Miao; Jovan Damjanovic; Luca Bischof; Michael B. Braun; Yingjie Ling; Marcus D. Hartmann; Yu-Shan Lin; Joshua A. Kritzer (J. Chem. Inf. Model., 2023)