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Understanding the evolution of a de novo molecule generator via characteristic functional group monitoring
Description/Abstract:
AIを用いた機能性有機化合物の開発。
Keyword:
De novo molecule generation
,
characteristic functional group monitoring
,
chromophore
, and
deep learning
Resource Type:
Article
Author:
Takehiro Fujita
,
Kei Terayama
,
Masato Sumita
,
Ryo Tamura
,
Yasuyuki Nakamura
,
Masanobu Naito
, and
Koji Tsuda
Date Uploaded:
15/02/2023
Date Modified:
20/03/2024
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Publication
1
Keyword
De novo molecule generation
1
characteristic functional group monitoring
1
chromophore
[remove]
1
deep learning
1
Language
English
1
Publisher
National Institute for Materials Science
1
Resource type
Article
1
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open
1
Rights Statement Sim
CC-BY-4.0
1
Author
Kei Terayama
1
Koji Tsuda
1
Masanobu Naito
1
Masato Sumita
1
Ryo Tamura
1
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