2021
DOI: 10.1016/j.molstruc.2021.129980
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Molecularly Imprinted Polymer (MIP) for thiamethoxam: A theoretical and experimental study

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Cited by 34 publications
(11 citation statements)
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“…It was observed that characteristic bands of TMX were present in AC-NP after sorption, such as the typical absorption band located between 1500 and 1600 cm −1 attributed to NO 2 groups (Silva et al 2021 ). The effect of the matrix (sugarcane juice) was not significant in the vibrational bands, indicating that this material can also be used in complex matrices with no substantial changes in its sorption sites.…”
Section: Resultsmentioning
confidence: 99%
“…It was observed that characteristic bands of TMX were present in AC-NP after sorption, such as the typical absorption band located between 1500 and 1600 cm −1 attributed to NO 2 groups (Silva et al 2021 ). The effect of the matrix (sugarcane juice) was not significant in the vibrational bands, indicating that this material can also be used in complex matrices with no substantial changes in its sorption sites.…”
Section: Resultsmentioning
confidence: 99%
“…This suggested that PILEGA could form a more stable complex with BPA. 27 Thus, PILEGA can be used as a functional monomer, i.e. , its oligomer (PICO) can be used as the functional monomer oligomer in this study.…”
Section: Resultsmentioning
confidence: 99%
“…For the rational design of MIPs, quantum chemical calculations were performed to estimate the conjugation between template molecules and functional monomers by measuring the electronic stabilisation energy of template-monomer complexes. 29 For the computer simulation, neutral amino acids were selected to construct the 4-pentenoyl-aminoacyl-glucosamine (PAAGA) functional monomer. The structures of SDI and PAACO/LAACO were optimised in the gas phase at the HF/6-31G(d) level, and the optimised geometry structures were verified without any imaginary frequency.…”
Section: Methodsmentioning
confidence: 99%