TY - JOUR A1 - Ravedutti Lucio Machado, Rafael A1 - Schmitt, Jonas A1 - Eibl, Sebastian A1 - Eitzinger, Jan A1 - Leißa, Roland A1 - Hack, Sebastian A1 - Pérard-Gayot, Arsène A1 - Membarth, Richard A1 - Köstler, Harald T1 - tinyMD: Mapping molecular dynamics simulations to heterogeneous hardware using partial evaluation JF - Journal of Computational Science UR - https://doi.org/10.1016/j.jocs.2021.101425 KW - Molecular dynamics KW - Partial evaluation KW - High performance computing KW - Load balancing Y1 - 2021 UR - https://doi.org/10.1016/j.jocs.2021.101425 SN - 1877-7503 VL - 2021 IS - 54 PB - Elsevier CY - Amsterdam ER - TY - CHAP A1 - Schmitt, Jonas A1 - Köstler, Harald A1 - Eitzinger, Jan A1 - Membarth, Richard T1 - Unified Code Generation for the Parallel Computation of Pairwise Interactions Using Partial Evaluation T2 - Proceedings 17th International Symposium on Parallel and Distributed Computing, ISPDC 2018 UR - https://doi.org/10.1109/ISPDC2018.2018.00012 KW - molecular dynamics KW - code generation KW - partial evaluation KW - gpu KW - neighbor lists Y1 - 2018 UR - https://doi.org/10.1109/ISPDC2018.2018.00012 SN - 978-1-5386-5330-2 SP - 17 EP - 24 PB - IEEE CY - Piscataway (NJ) ER - TY - INPR A1 - Ravedutti Lucio Machado, Rafael A1 - Schmitt, Jonas A1 - Eibl, Sebastian A1 - Eitzinger, Jan A1 - Leißa, Roland A1 - Hack, Sebastian A1 - Pérard-Gayot, Arsène A1 - Membarth, Richard A1 - Köstler, Harald T1 - tinyMD: A Portable and Scalable Implementation for Pairwise Interactions Simulations UR - https://doi.org/10.48550/arXiv.2009.07400 Y1 - 2020 UR - https://doi.org/10.48550/arXiv.2009.07400 PB - arXiv CY - Ithaca ER -