Cocrystal Prediction Using Machine Learning Models and Descriptors

Cocrystal Prediction Using Machine Learning Models and Descriptors

Cocrystals are of much interest in industrial application as well as academic research, and screening of suitable coformers for active pharmaceutical ingredients is the most crucial and challenging step in cocrystal development. Recently, machine learning techniques are attracting researchers in man...

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Bibliographic Details
Main Authors: Medard Edmund Mswahili, Min-Jeong Lee, Gati Lother Martin, Junghyun Kim, Paul Kim, Guang J. Choi, Young-Seob Jeong
Format: Article
Language:English
Published: MDPI AG 2021-02-01
Series:Applied Sciences
Subjects:
descriptor
machine learning
feature selection
cocrystal prediction
Online Access:https://www.mdpi.com/2076-3417/11/3/1323

Internet

https://www.mdpi.com/2076-3417/11/3/1323

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