NIMO: A Natural Product-Inspired Molecular Generative Model Based on Conditional Transformer

Natural products (NPs) have diverse biological activity and significant medicinal value. The structural diversity of NPs is the mainstay of drug discovery. Expanding the chemical space of NPs is an urgent need. Inspired by the concept of fragment-assembled pseudo-natural products, we developed a com...

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Bibliographic Details
Main Authors: Xiaojuan Shen, Tao Zeng, Nianhang Chen, Jiabo Li, Ruibo Wu
Format: Article
Language:English
Published: MDPI AG 2024-04-01
Series:Molecules
Subjects:
Online Access:https://www.mdpi.com/1420-3049/29/8/1867