Tatsuya Yoshizawa
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  • Publications
    • Generalizing molecular design via flexible search space control
    • A data-driven generative strategy to avoid reward hacking in multi-objective molecular design
    • ChemTSv2: Functional molecular design using de novo molecule generator
    • Selective Inhibitor Design for Kinase Homologs Using Multiobjective Monte Carlo Tree Search
  • Talks
    • Multi-Objective Optimization of Molecular Properties Integrating Boltz-2 and Pharmacokinetic Prediction
    • A generative strategy for reliable data-driven design of functional molecules
    • Molecule Generation with Boltz-2: A Case Study on Kinase Inhibitor Design
    • Molecular Generation Using a Diffusion Model-Based Binding Affinity Prediction Method
    • Introduction to DyRAMO: A Strategy for Reliable Data-Driven Molecular Design
    • Multi-Objective Molecular Optimization Considering the Reliability of Multiple Property Prediction Models
    • Multi-objective Molecular Structure Generation Using Dynamic Applicability Domains Adaptation
    • Design of Kinase-Selective Inhibitors Using a Reinforcement Learning-Based Molecular Generation Method
    • Design of Selective Inhibitors Using a Reinforcement Learning-Based Molecular Generation Method
    • Design of Selective Inhibitors Using ChemTS through Dscore-Based Multi-Objective Optimization
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    • ๐Ÿ‘ฉ๐Ÿผโ€๐Ÿซ Teach academic courses
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Multi-Objective Optimization of Molecular Properties Integrating Boltz-2 and Pharmacokinetic Prediction

Mar 27, 2026ยท
Tatsuya Yoshizawa
,
Tomohiro Sato
,
Masateru Ohta
,
Teruki Honma
,
Kei Terayama
ยท 0 min read
Publication
146th Annual Meeting of the Pharmaceutical Society of Japan. 2026/3/27
Date
Mar 27, 2026 12:00 AM
Last updated on Mar 27, 2026
A generative strategy for reliable data-driven design of functional molecules Dec 17, 2025 →
Languages:
English
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ยฉ 2026 Tatsuya Yoshizawa. This work is licensed under CC BY NC ND 4.0
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