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MolAICal: a soft tool for 3D drug design of protein targets by artificial intelligence and classical algorithm

Deep learning is an important branch of artificial intelligence that has been successfully applied into medicine and two-dimensional ligand design. The three-dimensional (3D) ligand generation in the 3D pocket of protein target is an interesting and challenging issue for drug design by deep learning...

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Detalles Bibliográficos
Autores principales: Bai, Qifeng, Tan, Shuoyan, Xu, Tingyang, Liu, Huanxiang, Huang, Junzhou, Yao, Xiaojun
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Oxford University Press 2020
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC7454275/
https://www.ncbi.nlm.nih.gov/pubmed/32778891
http://dx.doi.org/10.1093/bib/bbaa161