Kitasato University · Graduate School of Pharmaceutical Sciences / Department of Pharmacy / Faculty of Pharmaceutical Sciences · 准教授

Research keywords分子動力学・in silico Screening・in silico スクリーニング・医学・歯学・薬学・保健

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• Identifying inhibitors of USP7-HDM2 protein-protein interaction (PPI) by the in silico fragment-mapping method2019 · Yakugaku Zasshi
• Structure-based virtual screening for novel chymase inhibitors by in silico fragment mapping2019 · J. Mol. Graph. Model.
• ChemInform Abstract: Essential Structure of Opioid ϰ Receptor Agonist Nalfurafine for Binding to ϰ Receptor 1: Synthesis of Decahydroisoquinoline Derivatives and Their Pharmacologies.
• NMR spectroscopy and computational analysis of interaction between Serratia marcescens chitinase B and a dipeptide derived from natural-product cyclopentapeptide chitinase inhibitor argifin

• 分子動力学シミュレーションによるカルモデュリン-阻害剤複合体の溶液構造解析
• Determination of the Binding Site and Binding Mode of Ligand Molecules for a Protein Using Computer-Aided Ligand Docking
• In silico創薬技術を用いた新規キチナーゼ阻害剤の分子設計
• 計算創薬技術を用いたマクロライド骨格を持つ新規キチナーゼ阻害剤の構造最適化

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