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Predicting reversed-phase liquid chromatographic retention times of pesticides by deep neural networks
To be able to predict reversed phase liquid chromatographic (RPLC) retention times of contaminants is an asset in order to solve food contamination issues. The development of quantitative structure–retention relationship models (QSRR) requires selection of the best molecular descriptors and machine-...
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Formato: | Online Artículo Texto |
Lenguaje: | English |
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Elsevier
2021
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Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8671870/ https://www.ncbi.nlm.nih.gov/pubmed/34950792 http://dx.doi.org/10.1016/j.heliyon.2021.e08563 |