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Global reactivity models are impactful in industrial synthesis applications
Artificial Intelligence is revolutionizing many aspects of the pharmaceutical industry. Deep learning models are now routinely applied to guide drug discovery projects leading to faster and improved findings, but there are still many tasks with enormous unrealized potential. One such task is the rea...
Autores principales: | Neves, Paulo, McClure, Kelly, Verhoeven, Jonas, Dyubankova, Natalia, Nugmanov, Ramil, Gedich, Andrey, Menon, Sairam, Shi, Zhicai, Wegner, Jörg K. |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
Springer International Publishing
2023
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9921076/ https://www.ncbi.nlm.nih.gov/pubmed/36774523 http://dx.doi.org/10.1186/s13321-023-00685-0 |
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