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Maodong Li

Maodong Li appears in the imported research catalog. Authorship, coauthor and topic links are available while profile ownership is still unclaimed.

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2 published item(s)

preprint2026arXiv

Enhancing Target-Guided Proactive Dialogue Systems via Conversational Scenario Modeling and Intent-Keyword Bridging

A target-guided proactive dialogue system aims to steer conversations proactively toward pre-defined targets, such as designated keywords or specific topics. During guided conversations, dynamically modeling conversational scenarios and intent keywords to guide system utterance generation is beneficial; however, existing work largely overlooks this aspect, resulting in a mismatch with the dynamics of real-world conversations. In this paper, we jointly model user profiles and domain knowledge as conversational scenarios to introduce a scenario bias that dynamically influences system utterances, and employ intent-keyword bridging to predict intent keywords for upcoming dialogue turns, providing higher level and more flexible guidance. Extensive automatic and human evaluations demonstrate the effectiveness of conversational scenario modeling and intent keyword bridging, yielding substantial improvements in proactivity, fluency, and informativeness for target-guided proactive dialogue systems, thereby narrowing the gap with real world interactions.

preprint2026arXiv

Great Restraining Wall in Multidimensional Collective Variable Space

Enhanced sampling methods are pivotal for exploring rare events in molecular dynamics (MD), yet face challenges in high-dimensional collective variable (CV) spaces where exhaustive sampling becomes computationally prohibitive. While techniques like metadynamics (MetaD) and path-CV enable targeted free energy surface (FES) reconstruction, they often struggle with confinement stability, hyperparameter sensitivity, and geometric flexibility. This work introduces the Great Restraining Wall (GW) method, a robust framework for efficient FES sampling within predefined CV subspaces, addressing these limitations through a novel kernel density estimation (KDE)-derived restraining potential. GW operates by constructing a bias potential that confines sampling to user defined regions ranging from multidimensional masks to 1D pathways via asymptotically half-harmonic barriers. Unlike MetaD variants requiring iterative bias deposition, GW potential is derived from a cumulative distribution function, ensuring confinement without manual hyperparameter tuning. GW provides a versatile, stable, and efficient framework for targeted FES sampling, particularly beneficial for complex biomolecular systems with intricate CV landscapes. Its integration with existing enhanced sampling protocols opens avenues for studying ligand binding, conformational transitions, and other rare events with unprecedented precision. Future work will explore GW extension to adaptive regions and machine learning-guided CV discovery.