Evaluation of AlphaFold2 Structures for Hit Identification across Multiple Scenarios-Reference-Cited by-同舟云学术

Evaluation of AlphaFold2 Structures for Hit Identification across Multiple Scenarios

Published:2024-04-17 Issue:9 Volume:64 Page:3630-3639
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Gu Shukai¹²,Yang Yuwei¹,Zhao Yihao²,Qiu Jiayue¹,Wang Xiaorui³^ORCID,Tong Henry Hoi Yee¹,Liu Liwei⁴,Wan Xiaozhe⁴,Liu Huanxiang¹^ORCID,Hou Tingjun²^ORCID,Kang Yu²^ORCID

Affiliation:

1. Faculty of Applied Science, Macao Polytechnic University, Macao 999078, SAR, China

2. College of Pharmaceutical Sciences, Zhejiang University, Hangzhou 310058, Zhejiang, China

3. State Key Laboratory of Quality Re-search in Chinese Medicine, Macau Institute for Applied Research in Medicine and Health, Macau University of Science and Technology, Macao 999078, China

4. Advanced Computing and Storage Laboratory, Central Research Institute, 2012 Laboratories, Huawei Technologies Co., Ltd., Nanjing 210000, Jiangsu, China

Funder

National Key Research and Development Program of China

Fundamental Research Funds for the Central Universities

National Natural Science Foundation of China

Publisher

American Chemical Society (ACS)

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.3c01976

Reference45 articles.

1. Applications of chemogenomic library screening in drug discovery

2. Molecular Docking: A Powerful Approach for Structure-Based Drug Discovery

3. The rapidly evolving role of cryo-EM in drug design

4. The structural coverage of the human proteome before and after AlphaFold

5. Highly accurate protein structure prediction with AlphaFold

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