Ligand Efficiency Outperforms pIC50on Both 2D MLR and 3D CoMFA Models: A Case Study on AR Antagonists-Reference-Cited by-同舟云学术

Ligand Efficiency Outperforms pIC50on Both 2D MLR and 3D CoMFA Models: A Case Study on AR Antagonists

Author:

Li Jiazhong¹²,Bai Fang¹,Liu Huanxiang¹,Gramatica Paola³

Affiliation:

1. School of Pharmacy; Lanzhou University; 199 West Donggang Road 730000 Lanzhou China

2. The Separating Scientific Institute of Lanzhou; 3 Weiyi Road 730000 Lanzhou China

3. Department of Theoretical and Applied Sciences; University of Insubria; via Dunant 3 21100 Varese Italy

Funder

National Natural Science Foundation of China

Gansu Provincial Natural Science Foundation

Scientific Research Foundation for the Returned Overseas Chinese Scholars, State Education Ministry

Publisher

Wiley

Subject

Molecular Medicine,Biochemistry,Drug Discovery,Pharmacology,Organic Chemistry

Link

Reference33 articles.

3. The maximal affinity of ligands;Kuntz;Proc Natl Acad Sci USA,1999

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