Prediction Model of Organic Molecular Absorption Energies based on Deep Learning trained by Chaos-enhanced Accelerated Evolutionary algorithm

As an important physical property of molecules, absorption energy can characterize the electronic property and structural information of molecules. Moreover, the accurate calculation of molecular absorption energies is highly valuable. Present linear and nonlinear methods hold low calculation accura...

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Detalles Bibliográficos
Autores principales: Li, Mengshan, Lian, Suyun, Wang, Fan, Zhou, Yanying, Chen, Bingsheng, Guan, Lixin, Wu, Yan
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Nature Publishing Group UK 2019
Materias:
Article
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6872818/
https://www.ncbi.nlm.nih.gov/pubmed/31754116
http://dx.doi.org/10.1038/s41598-019-53206-1

Internet

https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6872818/
https://www.ncbi.nlm.nih.gov/pubmed/31754116
http://dx.doi.org/10.1038/s41598-019-53206-1

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