Using dimensionality reduction to systematically expand conformational sampling of intrinsically disordered peptides O Kukharenko, K Sawade, J Steuer, C Peter Journal of chemical theory and computation 12 (10), 4726-4734, 2016 | 34 | 2016 |
Towards a molecular basis of ubiquitin signaling: A dual-scale simulation study of ubiquitin dimers A Berg, O Kukharenko, M Scheffner, C Peter PLoS computational biology 14 (11), e1006589, 2018 | 32 | 2018 |
Back-mapping based sampling: Coarse grained free energy landscapes as a guideline for atomistic exploration S Hunkler, T Lemke, C Peter, O Kukharenko The Journal of Chemical Physics 151 (15), 2019 | 18 | 2019 |
Efficient Sampling and Characterization of Free Energy Landscapes of Ion–Peptide Systems T Lemke, C Peter, O Kukharenko Journal of chemical theory and computation 14 (11), 5476-5488, 2018 | 13 | 2018 |
Solution of the First Boundary‐Value Problem for a System of Autonomous Second‐Order Linear Partial Differential Equations of Parabolic Type with a Single Delay J Diblík, D Khusainov, O Kukharenko, Z Svoboda Abstract and Applied Analysis 2012 (1), 219040, 2012 | 9 | 2012 |
Fast conformational clustering of extensive molecular dynamics simulation data S Hunkler, K Diederichs, O Kukharenko, C Peter The Journal of chemical physics 158 (14), 2023 | 7 | 2023 |
Guanidine-II aptamer conformations and ligand binding modes through the lens of molecular simulation J Steuer, O Kukharenko, K Riedmiller, JS Hartig, C Peter Nucleic Acids Research 49 (14), 7954-7965, 2021 | 7 | 2021 |
Solution of the first boundary-value problem for a system of autonomous second-order linear PDEs of parabolic type with a single delay J Diblík, D Khusainov, O Kukharenko, Z Svoboda Abstr. Appl. Anal 2012, 2012 | 5 | 2012 |
Delayed exponential functions and their application to representations of solutions of linear equations with constant coefficients and with single delay J Diblík, B Morávková, D Khusainov, A Kukharenko Proceedings of the 2nd international conference on Mathematical Models for …, 2011 | 5 | 2011 |
Data-driven identification and analysis of the glass transition in polymer melts A Banerjee, HP Hsu, K Kremer, O Kukharenko ACS Macro Letters 12 (6), 679-684, 2023 | 4 | 2023 |
Representation of the solution for linear system of delay equations with distributed parameters J Diblik, D Khusainov, O Kukharenko Nonlinear dynamics and systems theory 12 (3), 251-268, 2012 | 4 | 2012 |
Determining glass transition in all-atom acrylic polymeric melt simulations using machine learning A Banerjee, A Iscen, K Kremer, O Kukharenko The Journal of Chemical Physics 159 (7), 2023 | 3 | 2023 |
Deep Learning to Analyze Sliding Drops S Shumaly, F Darvish, X Li, A Saal, C Hinduja, W Steffen, O Kukharenko, ... Langmuir 39 (3), 1111-1122, 2023 | 2 | 2023 |
Solution of the Cauchy Problem for Oscillatory Equation with Delay O Kukharenko arXiv preprint arXiv:1404.6655, 2014 | 2 | 2014 |
Control in systems of delay hyperbolic equations O Kukharenko Advances in Dynamical Systems and Applications 9 (2), 199-211, 2014 | 1 | 2014 |
Estimating sliding drop width via side-view features using recurrent neural networks S Shumaly, F Darvish, X Li, O Kukharenko, W Steffen, Y Guo, HJ Butt, ... Scientific Reports 14 (1), 12033, 2024 | | 2024 |
Multiscale approaches to model the functions of Ubiquitin and SUMO modifications in protein phase separation S Naskar, K Kremer, O Kukharenko Bulletin of the American Physical Society, 2024 | | 2024 |
Combining molecular dynamics simulations and scoring method to computationally model ubiquitylated linker histones in chromatosomes K Sawade, A Marx, C Peter, O Kukharenko PLoS Computational Biology 19 (8), e1010531, 2023 | | 2023 |
Generating a conformational landscape of ubiquitin chains at atomistic resolution by back-mapping based sampling S Hunkler, T Buhl, O Kukharenko, C Peter Frontiers in Chemistry 10, 1087963, 2023 | | 2023 |
Travelling through levels of resolution with machine-learning methods T Lemke, S Hunkler, O Kukharenko, C Peter ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 257, 2019 | | 2019 |