Cov_FB3D: A De Novo Covalent Drug Design Protocol Integrating the BA-SAMP Strategy and Machine-Learning-Based Synthetic Tractability Evaluation-Reference-Cited by-同舟云学术

Cov_FB3D: A De Novo Covalent Drug Design Protocol Integrating the BA-SAMP Strategy and Machine-Learning-Based Synthetic Tractability Evaluation

Published:2020-04-01 Issue:9 Volume:60 Page:4388-4402
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Wei Lin¹,Wen Wuqiang¹,Rao Li¹,Huang Yunyuan¹,Lei Mengting¹,Liu Kai²,Hu Saiya¹,Song Rongrong¹,Ren Yanliang¹^ORCID,Wan Jian¹^ORCID

Affiliation:

1. International Cooperation Base of Pesticide and Green Synthesis (Hubei), Key Laboratory of Pesticide & Chemical Biology (CCNU), Ministry of Education, Department of Chemistry, Central China Normal University, Wuhan 430079, China

2. Institute of Marine Drugs, Guangxi University of Chinese Medicine, Nanning, 530200, People’s Republic of China

Funder

National Natural Science Foundation of China

Program for the PCSIRT

the Program of Introducing Talents of Discipline to Universities of China

the self-determined research funds of CCNU from the colleges? basic research and operation of MOE

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.9b01197

Reference95 articles.

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