Improving de novo Molecule Generation by Embedding LSTM and Attention Mechanism in CycleGAN

The application of deep learning in the field of drug discovery brings the development and expansion of molecular generative models along with new challenges in this field. One of challenges in de novo molecular generation is how to produce new reasonable molecules with desired pharmacological, phys...

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Detalles Bibliográficos
Autores principales: Wang, Feng, Feng, Xiaochen, Guo, Xiao, Xu, Lei, Xie, Liangxu, Chang, Shan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Frontiers Media S.A. 2021
Materias:
Genetics
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8376287/
https://www.ncbi.nlm.nih.gov/pubmed/34422013
http://dx.doi.org/10.3389/fgene.2021.709500

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8376287/
https://www.ncbi.nlm.nih.gov/pubmed/34422013
http://dx.doi.org/10.3389/fgene.2021.709500

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