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Vibrational spectroscopic encoding of polystyrene-based resin beads: converting the encoding peaks into barcodes
Authors:Liu Lie-Xiong  Huang Zhen-Li  Zhao Yuan-Di
Institution:Key Laboratory of Biomedical Photonics of Ministry of Education & College of Life Science and Technology, Huazhong University of Science and Technology, Wuhan 430074, PR China.
Abstract:A detailed approach is described for the vibrational spectroscopic encoding of polystyrene-based resin beads by converting the infrared absorption peaks suitable for encoding (encoding peaks) into barcodes. Based on combining the FT-IR measurements and the quantum-chemical computations, the vibrational characteristics of p-tert-butylstyrene monomer, polystyrene and poly(p-tert-butylstyrene) resin beads are analyzed, which are helpful for the selection of encoding peaks. The vibrational spectroscopic encoding of polystyrene-based resin beads could be obtained by converting the wavenumber, intensity and full width at half maximum (FWHM) of the encoding peaks into barcodes automatically through a computer program designed in our laboratory.
Keywords:Combinatorial chemistry  Polymeric resin bead  Spectroscopic encoding  Quantum-chemical computations  High-throughput screening
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