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Author

Kai Xu

Observed institution: Macao Polytechnic University
ORCID: 0009-0003-3057-921X
Observed ORCID: 0009-0003-3057-921X
OpenAlex ID: A5134614468
TPS-Flow: Physics-Guided Flow-Based Generative Modeling of Protein Transition Paths
2026 · Kai Xu, Likun Zhao, et al. · Journal of Chemical Information and Modeling · 1
Integrative Computational Strategies for Dynamic GPCR Landscapes: From Conformational Mechanisms to Drug Design
2026 · Jieying Zang, Shihang Wang, et al. · Wiley Interdisciplinary Reviews Computational Molecular Science · 1
Supervised fine-tuning enhances unsupervised learning from 45 million amino acids in TCR and peptide sequences
2026 · Kewei Zhou, Kai Xu, et al. · Bioinformatics · 1
Task-adaptive multimodal molecular representations for structure-sensitive property prediction
2026 · Shaolong Lin, Silong Zhai, et al. · Chemical Science · 1
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Leveraging Contrastive Learning for Conditional and Robust TCR Sequence Generation
2026 · Kewei Zhou, Shaolong Lin, et al. · Journal of Chemical Information and Modeling
CoCoBind: Consistency-Contrastive Multitask Learning for RNA–Ligand Interaction and Binding Site Prediction
2026 · Shihang Wang, Lin Wang, et al. · Journal of Medicinal Chemistry
An OpenMM-Based ML/MM–MMGBSA Workflow for End-point Protein–Ligand Binding Energy Ranking
2026 · Chenchen Wang, Shihang Wang, et al. · Journal of Chemical Information and Modeling
Works count: 7
Citation count: 4
H-index: 1
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