2 papers
cs.LG2026
Molecular Representations in Implicit Functional Space via Hyper-Networks
Zehong Wang, Xiaolong Han, Qi Yang +10
Molecular representations fundamentally shape how machine learning systems reason about molecular structure and physical properties. Most existing approaches adopt a discrete pipel…
quant-ph2024
Robust Quantum Reservoir Computing for Molecular Property Prediction
Daniel Beaulieu, Milan Kornjaca, Zoran Krunic +4
Machine learning has been increasingly utilized in the field of biomedical research to accelerate the drug discovery process. In recent years, the emergence of quantum computing ha…