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Auto In Silico Ligand Directing Evolution to Facilitate the Rapid and Efficient Discovery of Drug Lead

Motivated by the growing demand for reducing the chemical optimization burden of H2L, we developed auto in silico ligand directing evolution (AILDE, http://chemyang.ccnu.edu.cn/ccb/server/AILDE), an efficient and general approach for the rapid identification of drug leads in accessible chemical spac...

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Detalhes bibliográficos
Publicado no:iScience
Main Authors: Wu, Fengxu, Zhuo, Linsheng, Wang, Fan, Huang, Wei, Hao, Gefei, Yang, Guangfu
Formato: Artigo
Idioma:Inglês
Publicado em: Elsevier 2020
Assuntos:
Acesso em linha:https://ncbi.nlm.nih.gov/pmc/articles/PMC7267738/
https://ncbi.nlm.nih.gov/pubmed/32498019
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1016/j.isci.2020.101179
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