A SAR and QSAR study on cyclin dependent kinase 4 inhibitors using machine learning methods

Author:

Pang Xiaoyang1,Zhao Yunyang1,Li Guo1,Liu Jianrong2,Yan Aixia1ORCID

Affiliation:

1. State Key Laboratory of Chemical Resource Engineering, Department of Pharmaceutical Engineering, Beijing University of Chemical Technology, Beijing, P. R. China

2. BUCT-Paris Curie Engineer School, Beijing University of Chemical Technology, Beijing 100029, P. R. China

Abstract

Machine learning methods are used to predict the inhibitory activity of the compound targeting cyclin dependent kinase 4 (CDK4), and analyse fragment features of CDK4 inhibitors.

Publisher

Royal Society of Chemistry (RSC)

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