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Journal of Chemical Theory and Computation|November 10, 2020
Extensible and Scalable Adaptive Sampling on SupercomputersEugen Hruska, Vivekanandan Balasubramanian, Hyungro Lee, et al.Health Information Science and Systems|April 1, 2015
Bio and health informatics meets cloud : BioVLab as an exampleHeejoon Chae, Inuk Jung, Hyungro Lee, et al.Bioinformatics (Oxford, England)|May 7, 2016
MGEScan: a Galaxy-based system for identifying retrotransposons in genomesHyungro Lee, Minsu Lee, Wazim Mohammed Ismail, et al.Journal of Chemical Information and Modeling|September 4, 2023
Adaptive Ensemble Refinement of Protein Structures in High Resolution Electron Microscopy Density Maps with Radical Augmented Molecular Dynamics Flexible FittingDaipayan Sarkar, Hyungro Lee, John W Vant, et al.IEEE Transactions on Nanobioscience|September 19, 2012
BioVLAB-MMIA: a cloud environment for microRNA and mRNA integrated analysis (MMIA) on Amazon EC2Hyungro Lee, Youngik Yang, Heejoon Chae, et al.Methods in Molecular Biology (Clifton, N.J.)|April 20, 2021
Large-Scale Molecular Dynamics Simulations of Cellular CompartmentsEric Wilson, John Vant, Jacob Layton, et al.Journal of Open Source Software|August 18, 2025
alchemlyb: the simple alchemistry libraryZhiyi Wu, David L Dotson, Irfan Alibay, et al.Biorxiv : the Preprint Server for Biology|November 25, 2020
AI-Driven Multiscale Simulations Illuminate Mechanisms of SARS-CoV-2 Spike DynamicsLorenzo Casalino, Abigail Dommer, Zied Gaieb, et al.Journal of Chemical Information and Modeling|November 18, 2021
High-Throughput Virtual Screening and Validation of a SARS-CoV-2 Main Protease Noncovalent InhibitorAustin Clyde, Stephanie Galanie, Daniel W Kneller, et al.The International Journal of High Performance Computing Applications|April 11, 2024
AI-driven multiscale simulations illuminate mechanisms of SARS-CoV-2 spike dynamicsLorenzo Casalino, Abigail C Dommer, Zied Gaieb, et al.Pageof 2