| High-throughput virtual screening and validation of a SARS-CoV-2 main protease noncovalent inhibitor A Clyde, S Galanie, DW Kneller, H Ma, Y Babuji, B Blaiszik, A Brace, ... Journal of chemical information and modeling 62 (1), 116-128, 2021 | 113 | 2021 |
| Design and performance characterization of radical-pilot on leadership-class platforms A Merzky, M Turilli, M Titov, A Al-Saadi, S Jha IEEE Transactions on Parallel and Distributed Systems 33 (4), 818-829, 2021 | 48 | 2021 |
| Impeccable: Integrated modeling pipeline for covid cure by assessing better leads AA Saadi, D Alfe, Y Babuji, A Bhati, B Blaiszik, A Brace, T Brettin, K Chard, ... Proceedings of the 50th International Conference on Parallel Processing, 1-12, 2021 | 42 | 2021 |
| Pandemic drugs at pandemic speed: infrastructure for accelerating COVID-19 drug discovery with hybrid machine learning-and physics-based simulations on high-performance computers AP Bhati, S Wan, D Alfè, AR Clyde, M Bode, L Tan, M Titov, A Merzky, ... Interface focus 11 (6), 20210018, 2021 | 41 | 2021 |
| Workflows community summit 2022: A roadmap revolution RF Da Silva, RM Badia, V Bala, D Bard, PT Bremer, I Buckley, ... arXiv preprint arXiv:2304.00019, 2023 | 37 | 2023 |
| Exaworks: Workflows for exascale A Al-Saadi, DH Ahn, Y Babuji, K Chard, J Corbett, M Hategan, S Herbein, ... 2021 IEEE Workshop on Workflows in Support of Large-Scale Science (WORKS), 50-57, 2021 | 34 | 2021 |
| Scalable HPC & AI infrastructure for COVID-19 therapeutics H Lee, A Merzky, L Tan, M Titov, M Turilli, D Alfe, A Bhati, A Brace, ... Proceedings of the Platform for Advanced Scientific Computing Conference, 1-13, 2021 | 25 | 2021 |
| Big data: nil novo sub luna AA Balyakin, AS Malyshev, MV Nurbina, MA Titov Integrated Science in Digital Age: ICIS 2019, 364-373, 2020 | 10 | 2020 |
| Data visualization and representation in ATLAS BigPanDA monitoring S Padolski, T Korchuganova, T Wenaus, M Grigorieva, A Alexeev, M Titov, ... Научная визуализация 10 (1), 69-76, 2018 | 10 | 2018 |
| A probabilistic analysis of data popularity in ATLAS data caching M Titov, G Zaruba, A Klimentov, K De Journal of Physics: Conference Series 396 (3), 032106, 2012 | 7 | 2012 |
| Uncertainty quantification of metal additive manufacturing processing conditions through the use of exascale computing R Carson, M Rolchigo, J Coleman, M Titov, J Belak, M Bement Proceedings of the SC'23 Workshops of the International Conference on High …, 2023 | 6 | 2023 |
| Radical-pilot and pmix/prrte: Executing heterogeneous workloads at large scale on partitioned hpc resources M Titov, M Turilli, A Merzky, T Naughton, W Elwasif, S Jha Workshop on Job Scheduling Strategies for Parallel Processing, 88-107, 2022 | 5 | 2022 |
| Social aspects of big data technology implementation AA Balyakin, SB Taranenko, MV Nurbina, MA Titov ICS. J. Digit. Sci 1 (1), 15-24, 2019 | 5 | 2019 |
| An Application of Visual Analytics Methods to Cluster and Categorize Data Processing Jobs in High Energy and Nuclear Physics Experiments T Galkin, M Grigoryeva, A Klimentov, T Korchuganova, I Milman, ... Scientific Visualization 10 (5), 32-44, 2018 | 5 | 2018 |
| Novel approaches toward scalable composable workflows in hyper-heterogeneous computing environments J Bader, J Belak, M Bement, M Berry, R Carson, D Cassol, S Chan, ... Proceedings of the SC'23 Workshops of the International Conference on High …, 2023 | 4 | 2023 |
| The ghost of performance reproducibility past S Ramesh, M Titov, M Turilli, S Jha, A Malony 2022 IEEE 18th International Conference on e-Science (e-Science), 513-518, 2022 | 4 | 2022 |
| Workflow Mini-Apps: Portable, Scalable, Tunable & Faithful Representations of Scientific Workflows OO Kilic, T Wang, M Turilli, M Titov, A Merzky, L Pouchard, S Jha 2024 IEEE 24th International Symposium on Cluster, Cloud and Internet …, 2024 | 3 | 2024 |
| Workflows Community Summit 2022: A Roadmap Revolution R Ferreira Da Silva, R Badia, V Bala, D Bard, PT Bremer, I Buckley, ... Oak Ridge National Laboratory (ORNL), Oak Ridge, TN (United States), 2023 | 3 | 2023 |
| Advanced Analytics service to enhance workflow control at the ATLAS Production System M Titov, M Borodin, D Golubkov, A Klimentov EPJ Web of Conferences 214, 03007, 2019 | 3 | 2019 |
| The new approach to monitor the workflow management system ProdSys2/PanDA of the ATLAS experiment at LHC by using methods and techniques of visual analytics T Galkin, M Grigoryeva, A Klimentov, T Korchuganova, I Milman, ... Scientific Visualization 10 (1), 77-88, 2018 | 3 | 2018 |
