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Masakazu Sekijima

Showing results (1-10 of 44) with videos related to

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Journal of Chemical Information and Modeling|February 28, 2019
Improved Method of Structure-Based Virtual Screening via Interaction-Energy-Based LearningNobuaki Yasuo, Masakazu Sekijima
Journal of Chemical Information and Modeling|December 19, 2024
DiffInt: A Diffusion Model for Structure-Based Drug Design with Explicit Hydrogen Bond Interaction GuidanceMasami Sako, Nobuaki Yasuo, Masakazu Sekijima
Parasitology International|April 29, 2021
Computer aided drug discovery review for infectious diseases with case study of anti-Chagas projectNobuaki Yasuo, Takashi Ishida, Masakazu Sekijima
Journal of Chemical Information and Modeling|April 25, 2026
A Transformer for Reaction-Aware Compound Explorations with GFlowNet in QSAR-Guided Molecular DesignShogo Nakamura, Nobuaki Yasuo, Masakazu Sekijima
Journal of Cheminformatics|November 28, 2021
MERMAID: an open source automated hit-to-lead method based on deep reinforcement learningDaiki Erikawa, Nobuaki Yasuo, Masakazu Sekijima
Scientific Reports|July 29, 2020
Identification of key interactions between SARS-CoV-2 main protease and inhibitor drug candidatesRyunosuke Yoshino, Nobuaki Yasuo, Masakazu Sekijima
Scientific Reports|November 27, 2019
Molecular Dynamics Simulation reveals the mechanism by which the Influenza Cap-dependent Endonuclease acquires resistance against Baloxavir marboxilRyunosuke Yoshino, Nobuaki Yasuo, Masakazu Sekijima
Communications Chemistry|February 8, 2025
Molecular optimization using a conditional transformer for reaction-aware compound exploration with reinforcement learningShogo Nakamura, Nobuaki Yasuo, Masakazu Sekijima
Npj Drug Discovery|June 30, 2026
Interaction-constrained 3D molecular generation using a diffusion model enables structure-based pharmacophore modeling for drug designMasami Sako, Nobuaki Yasuo, Masakazu Sekijima
Methods in Molecular Biology (Clifton, N.J.)|November 22, 2024
Bioinformatics Approaches for Understanding the Binding Affinity of Protein-Nucleic Acid ComplexesK Harini, Masakazu Sekijima, M Michael Gromiha
Pageof 5

Showing results (1-10 of 44) with videos related to

Sort By:
Pageof 5
Journal of Chemical Information and Modeling|February 28, 2019
Improved Method of Structure-Based Virtual Screening via Interaction-Energy-Based LearningNobuaki Yasuo, Masakazu Sekijima
Journal of Chemical Information and Modeling|December 19, 2024
DiffInt: A Diffusion Model for Structure-Based Drug Design with Explicit Hydrogen Bond Interaction GuidanceMasami Sako, Nobuaki Yasuo, Masakazu Sekijima
Parasitology International|April 29, 2021
Computer aided drug discovery review for infectious diseases with case study of anti-Chagas projectNobuaki Yasuo, Takashi Ishida, Masakazu Sekijima
Journal of Chemical Information and Modeling|April 25, 2026
A Transformer for Reaction-Aware Compound Explorations with GFlowNet in QSAR-Guided Molecular DesignShogo Nakamura, Nobuaki Yasuo, Masakazu Sekijima
Journal of Cheminformatics|November 28, 2021
MERMAID: an open source automated hit-to-lead method based on deep reinforcement learningDaiki Erikawa, Nobuaki Yasuo, Masakazu Sekijima
Scientific Reports|July 29, 2020
Identification of key interactions between SARS-CoV-2 main protease and inhibitor drug candidatesRyunosuke Yoshino, Nobuaki Yasuo, Masakazu Sekijima
Scientific Reports|November 27, 2019
Molecular Dynamics Simulation reveals the mechanism by which the Influenza Cap-dependent Endonuclease acquires resistance against Baloxavir marboxilRyunosuke Yoshino, Nobuaki Yasuo, Masakazu Sekijima
Communications Chemistry|February 8, 2025
Molecular optimization using a conditional transformer for reaction-aware compound exploration with reinforcement learningShogo Nakamura, Nobuaki Yasuo, Masakazu Sekijima
Npj Drug Discovery|June 30, 2026
Interaction-constrained 3D molecular generation using a diffusion model enables structure-based pharmacophore modeling for drug designMasami Sako, Nobuaki Yasuo, Masakazu Sekijima
Methods in Molecular Biology (Clifton, N.J.)|November 22, 2024
Bioinformatics Approaches for Understanding the Binding Affinity of Protein-Nucleic Acid ComplexesK Harini, Masakazu Sekijima, M Michael Gromiha
Pageof 5