3 citations · 6 across the 8 of their papers we have counts for
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Evaluating Molecule Synthesizability via Retrosynthetic Planning and Reaction Prediction
Songtao Liu, Dandan Zhang, Zhengkai Tu +2
A significant challenge in wet lab experiments with current drug design generative models is the trade-off between pharmacological properties and synthesizability. Molecules predic…
The Spectral Amplitude Principle for Dynamics of Quantum Neural Networks
Yi-hang Xu, Dan-Bo Zhang, Junchi Yan
The mechanism governing the training dynamics of Quantum Neural Networks (QNNs) remains under-explored. In classical Deep Neural Networks (DNNs), training is dominated by "Spectral…
Variational quantum simulation of ground states and thermal states for lattice gauge theory with multi-objective optimization
Lang-Xing Cheng, Dan-Bo Zhang
Variational quantum algorithms provide feasible approaches for simulating quantum systems and are applied widely. For lattice gauge theory, however, variational quantum simulation…
Simulating Parton Fragmentation on Quantum Computers
Tianyin Li, Hongxi Xing, Dan-Bo Zhang
Parton fragmentation functions (FFs) are indispensable for understanding processes of hadron production ubiquitously existing in high-energy collisions, but their first principle d…