Shogo Nakamura

4PUBLICATIONS
3CO-AUTHORS
Process control and simulationChemical engineering designBiomolecular modelling and design
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Publications (4)

|Apr 25, 2026
A Transformer for Reaction-Aware Compound Explorations with GFlowNet in QSAR-Guided Molecular Design.

|Feb 08, 2025
Molecular optimization using a conditional transformer for reaction-aware compound exploration with reinforcement learning.

Shogo Nakamura, Nobuaki Yasuo, Masakazu Sekijima

|Sep 10, 2024
IEV2Mol: Molecular Generative Model Considering Protein-Ligand Interaction Energy Vectors.

Mami Ozawa, Shogo Nakamura, Nobuaki Yasuo

|Oct 16, 2023
Gargoyles: An Open Source Graph-Based Molecular Optimization Method Based on Deep Reinforcement Learning.

Daiki Erikawa, Nobuaki Yasuo, Takamasa Suzuki

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Frequent Collaborators

4 joint publications

Masakazu Sekijima

3 joint publications

Nobuaki Yasuo

1 joint publications

Takamasa Suzuki