Guiding Application Users via Estimation of Computational Resources for Massively Parallel Chemistry Computations

Tanzila Tabassum, Omer Subasi, Ajay Panyala, Epiya Ebiapia, Gerald Baumgartner, Erdal Mutlu, P. Sadayappan, Karol Kowalski. Guiding Application Users via Estimation of Computational Resources for Massively Parallel Chemistry Computations. In Proceedings of the SC '25 Workshops of the International Conference for High Performance Computing, Networking, Storage and Analysis, SC Workshops 2025, St Louis, MO, USA, November 16-21, 2025. pages 11-19, ACM, 2025. [doi]

Abstract

Abstract is missing.