Publications

Molecular dynamics workflow decomposition for hybrid classic/quantum systems

Abstract

Since we are entering the Post-Moore Law era and consequently the limit of Von Neumann's architecture, the scientific community is looking for alternatives to satisfy the growing computing power demands of scientific applications. Quantum computing promises to achieve a computational advantage over the classic Von Neumann architecture. However, the limited capabilities of current noisy intermediate-scale quantum (NISQ) devices require quantum computers to interoperate with classic systems, forming the so-called hybrid quantum systems. Research on hybrid quantum systems led to the design of Variational Quantum Algorithms, currently the most promising way to move towards quantum advantage. However, execution time and accuracy of variational quantum algorithms are affected by different hyperparameters, including selected cost functions and parametrized quantum circuits. Consequently, providing …

Date
2022
Authors
Sandeep Suresh Cranganore, Vincenzo De Maio, Ivona Brandic, Tu Mai Anh Do, Ewa Deelman
Conference
2022 IEEE 18th International Conference on e-Science (e-Science)
Pages
346-356
Publisher
IEEE