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Parallel History Matching and Associated Forecast at the Center for Interactive Smart Oilfield Technologies., , , , and . PDPTA, page 369-372. CSREA Press, (2005)A high-throughput multiobjective genetic-algorithm workflow for in situ training of reactive molecular-dynamics force fields., , , , , and . SpringSim (HPS), page 2. ACM, (2016)Info-Bio-Nano Interface: High-Performance Computing & Visualization., , and . HiPC, volume 2552 of Lecture Notes in Computer Science, page 3-8. Springer, (2002)A Rigid-Body-Based Multiple Time Scale Molecular Dynamics Simulation of Nanophase Materials.. Int. J. High Perform. Comput. Appl., 13 (2): 154-162 (1999)Exploiting hierarchical parallelisms for molecular dynamics simulation on multicore clusters., , , , , , , and . J. Supercomput., 57 (1): 20-33 (2011)Ab initio molecular dynamics study of prebiotic production processes of organic compounds at meteorite impacts on ocean., , , and . J. Comput. Chem., 40 (2): 349-359 (2019)Multiresolution load balancing in curved space: the wavelet representation.. Concurr. Pract. Exp., 11 (7): 343-353 (1999)VLA-SMILES: Variable-Length-Array SMILES Descriptors in Neural Network-Based QSAR Modeling., and . Mach. Learn. Knowl. Extr., 4 (3): 715-737 (2022)Performance Characteristics of Hardware Transactional Memory for Molecular Dynamics Application on BlueGene/Q: Toward Efficient Multithreading Strategies for Large-Scale Scientific Applications., , , , , and . IPDPS Workshops, page 1326-1335. IEEE, (2013)Neural Network Molecular Dynamics at Scale., , , , , , , and . IPDPS Workshops, page 991-994. IEEE, (2020)