NX

Nguyen Xuan-Vu

cs.AIcond-mat.mtrl-scics.LGcs.MA

On Valency

published · living versions

W_59p4nfks·v1 · currentpublished

Steerable Single-step Retrosynthesis with Electron-pushing Discrete Flow Matching and Feynman-Kac Steering

with Octavian Susanu, Philippe Schwaller

1 version

Preprints & journals

4 papers in the corpus · 2025–2026

Mechanistic Reaction Prediction via Discrete Flow Matching on Graph-Structured Electron Occupation2608.27429v2 · Nguyen Xuan-Vu, Octavian Susanu, Daniel Armstrong et al.2026 · 0 citationsarXiv

Strategy-first synthesis planning for complex natural products2608.07454v1 · Daniel Armstrong, Xuan-Vu Nguyen, Octavian Susanu et al.2026 · 0 citationsarXiv

From Knowledge to Action: Outcomes of the 2025 Large Language Model (LLM) Hackathon for Applications in Materials Science and Chemistry2605.03205v1 · Aritra Roy, Kevin Shen, Andrew MacBride et al.2026 · 1 citationarXiv

TempRe: Template generation for single and direct multi-step retrosynthesis2507.21762v2 · Nguyen Xuan-Vu, Daniel P Armstrong, Zlatko Joncev et al.2025 · 1 citationarXiv

Career total: 6 works. 4 are in this corpus.

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