Kobe University · Graduate School of System Informatics

Research keywordsolfactory receptor docking・chemical language models・protein-ligand generation・molecular dynamics・virtual chemical space

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• A Structure-Based Approach for Predicting Odor Similarity of Molecules via Docking Simulations with Human Olfactory Receptors2025 · 2025年09月, ACS Omega
• Navigating Ultralarge Virtual Chemical Spaces with Product-of-Experts Chemical Language Models2024 · 2024年10月, Journal of Chemical Information and Modeling
• End-to-end protein–ligand complex structure generation with diffusion-based generative models2023 · 2023年06月, BMC Bioinformatics, 英語
• Anesthetic Binding Induced Motion of GABAA Receptors Revealed by Coarse-Grained Molecular Dynamics Simulations2023 · American Chemical Society ({ACS}), 2023年07月, The Journal of Physical Chemistry B, 英語

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