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2021
DOI: 10.1016/j.jddst.2021.102630
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Citrulline malate transdermal delivery through integrating into polyvinyl alcohol (PVA) nanofibers

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Cited by 4 publications
(4 citation statements)
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“…It is important to mention that these theoretical methods alone or complemented with the obtained experimental results can offer advantages to the design, in addition to predicting and explaining the structural properties in miscellaneous nanoand biomaterials [38][39][40]. Additionally, the achieved theoretical results provide excellent support to appropriately assign and correlate both bands and signals from several analytical techniques: UV-VIS, Raman, infrared and NMR [41][42][43][44]. In this sense, density functional theory (DFT) calculations have been useful and competent in predicting materials' properties [39,43,45,46].…”
Section: Introductionmentioning
confidence: 83%
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“…It is important to mention that these theoretical methods alone or complemented with the obtained experimental results can offer advantages to the design, in addition to predicting and explaining the structural properties in miscellaneous nanoand biomaterials [38][39][40]. Additionally, the achieved theoretical results provide excellent support to appropriately assign and correlate both bands and signals from several analytical techniques: UV-VIS, Raman, infrared and NMR [41][42][43][44]. In this sense, density functional theory (DFT) calculations have been useful and competent in predicting materials' properties [39,43,45,46].…”
Section: Introductionmentioning
confidence: 83%
“…Regarding the quantum chemical literature [55], the B3LYP functional yields a good description of harmonic vibrational wavenumbers. However, the quantum chemical results differ from the measured ones and, consequently, these calculations were scaled; in this sense, the thermal contributions to the vibrational energy were scaled by 0.963 [43,44].…”
Section: Vibrational Analysismentioning
confidence: 99%
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