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Predicting emission spectra of fluorescent materials from their absorbance spectra using the artificial neural network

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Języki publikacji
EN
Abstrakty
EN
Artificial neural networks have been shown to be able to approximate any continuous nonlinear functions and have been used to build data based empirical models for nonlinear processes. This work studies primarily the performance of neural networks as a tool for predicting the emission spectra of fluorescent materials from their absorbance, and further, tends to the determination of the optimal topology of the neural network for this purpose. In order to do this, spectral data were initially analyzed by a principal component analysis technique. The first four principal components were used as input nodes of neural networks with various training algorithms – namely cascade- and feed-forward algorithms – and also, various numbers of hidden layers and nodes. The obtained results indicate that the RMS error in a testing data set decreased with increasing the number of neurons and the minimal network architecture for a data prediction problem consists of two hidden layers, respectively with 9 and 1 nodes for both neural networks. Additionally, a better performance was obtained with the cascade-forward neural network, especially in a small number of nodes. The obtained results indicate that the neural networks can be used to provide a relationship between the absorbance as an input and the emission as a target.
Słowa kluczowe
Czasopismo
Rocznik
Strony
545--557
Opis fizyczny
Bibliogr. 30 poz., rys., tab.
Twórcy
  • Textile Engineering Department, University of Guilan, Rasht, Iran
  • Center of Excellence for Color Science and Technology, Tehran, Iran
autor
  • Textile Engineering Department, University of Guilan, Rasht, Iran
Bibliografia
  • [1] SEONG-IL UM, YONGHAN KANG, JOON-KYUN LEE, The synthesis and properties of triazine-stilbene fluorescent brighteners containing a monophenolic antioxidant, Dyes and Pigments 75(3), 2007, pp. 681–686.
  • [2] CHRISTIE R.M., MORGAN K.M., SAIFUL ISLAM M., Molecular design and synthesis of N-arylsulfonated coumarin fluorescent dyes and their application to textiles, Dyes and Pigments 76(3), 2008, pp. 741–747.
  • [3] STANEVA D., GRABCHEV I., BETCHEVA R., Sensor potential of 1,8-naphthalimide and its dyeing ability of cotton fabric, Dyes and Pigments 98(1), 2013, pp. 64–70.
  • [4] KAUR B., BHATTACHARYA S.N., HENRY D.J., Interpreting the near-infrared reflectance of a series of perylene pigments, Dyes and Pigments 99(2), 2013, pp. 502–511.
  • [5] GOMES E.C.C., DE CARVALHO I.M.M., DIÓGENES I.C.N., DE SOUSA E.H.S., LONGHINOTTI E., On the incorporation of Rhodamine B and 2',7'-dichlorofluorescein dyes in silica: synthesis of fluorescent nanoparticles, Optical Materials 36(7), 2014, pp. 1197–1202.
  • [6] MARKOVA L.I., TERPETSCHNIG E.A., PATSENKER L.D., Comparison of a series of hydrophilic squaraine and cyanine dyes for use as biological labels, Dyes and Pigments 99(3), 2013, pp. 561–570.
  • [7] SAUER M., HOFKENS J., ENDERLEIN J., Handbook of Fluorescence Spectroscopy and Imaging: From Ensemble to Single Molecules, Wiley-VCH, Weinheim, 2011.
  • [8] LAKOWICZ J.R., Principles of Fluorescence Spectroscopy, 3rd Ed., Springer US, 2006.
  • [9] SATAM M.A., RAUT R.K., SEKAR N., Fluorescent azo disperse dyes from 3-(1,3-benzothiazol-2-yl)- naphthalen-2-ol and comparison with 2-naphthol analogs, Dyes and Pigments 96(1), 2013, pp. 92–103.
  • [10] AIFENG LIU, LIANG YANG, ZHENYU ZHANG, ZHILAN ZHANG, DONGMEI XU, A novel rhodamine-based colorimetric and fluorescent sensor for the dual-channel detection of Cu2+ and Fe3+ in aqueous solutions, Dyes and Pigments 99(2), 2013, pp. 472–479.
  • [11] DIBYENDU DEY, JABA SAHA, ARPAN DATTA ROY, BHATTACHARJEE D., SYED ARSHAD HUSSAIN, Development of an ion-sensor using fluorescence resonance energy transfer, Sensors and Actuators B: Chemical 195, 2014, pp. 382–388.
  • [12] OOYAMA Y., SHIMADA Y., KAGAWA Y., YAMADA Y., IMAE I., KOMAGUCHI K., HARIMA Y., Synthesis of new-type donor-acceptor π-conjugated benzofuro[2,3-c]oxazolo[4,5-a]carbazole fluorescent dyes and their photovoltaic performances of dye-sensitized solar cells, Tetrahedron Letters 48(52), 2007, pp. 9167–9170.
  • [13] KOZMA E., CATELLANI M., Perylene diimides based materials for organic solar cells, Dyes and Pigments 98(1), 2013, pp. 160–179.
  • [14] SHUCAI LIANG, YANBIN LIU, JIN XIANG, MENG QIN, HUI YU, GUOPING YAN, Fabrication of a new fluorescent polymeric nanoparticle containing naphthalimide and investigation on its interaction with bovine serum albumin, Colloids and Surfaces B: Biointerfaces 116, 2014, pp. 206–210.
  • [15] BETTATI S., PASQUALETTO E., LOLLI G., CAMPANINI B., BATTISTUTTA R., Structure and single crystal spectroscopy of Green Fluorescent Proteins, Biochimica et Biophysica Acta (BBA) – Proteins and Proteomics 1814(6), 2011, pp. 824–833.
  • [16] WOLD S., ESBENSEN K., GELADI P., Principal component analysis, Chemometrics and Intelligent Laboratory Systems 2(1–3), 1987, pp. 37–52.
  • [17] WESTLAND S., RIPAMONTI C., Computational Colour Science Using MATLAB, John Wiley & Sons, 2004.
  • [18] VEIT D., Neural networks and their application to textile technology, [In] Simulation in Textile Technology, 1st Ed., Woodhead Publishing Limited, 2012, pp. 9–71.
  • [19] RUEY-FANG YU, CHUANG-HUNG LIN, HO-WEN CHEN, WEN-PO CHENG, MING-CHIEN KAO, Possible control approaches of the Electro-Fenton process for textile wastewater treatment using on-line monitoring of DO and ORP, Chemical Engineering Journal 218, 2013, pp. 341–349.
  • [20] KUMAR A., Neural network based detection of local textile defects, Pattern Recognition 36(7), 2003, pp. 1645–1659.
  • [21] STANIKUNAS R., VAITKEVICIUS H., KULIKOWSKI J.J., Investigation of color constancy with a neural network, Neural Networks 17(3), 2004, pp. 327–337.
  • [22] KAYDANI H., MOHEBBI A., A comparison study of u sing optimization algorithms and artificial neural networks for predicting permeability, Journal of Petroleum Science and Engineering 112, 2013, pp. 17–23.
  • [23] ADDEH J., EBRAHIMZADEH A., AZARBAD M., RANAEE V., Statistical process control using optimized neural networks: a case study, ISA Transactions 53(5), 2014, pp. 1489–1499.
  • [24] FENG LUAN, XUAN XU, HUITAO LIU, DIAS SOEIRO CORDEIRO M.N., Review of quantitative structure-activity/property relationship studies of dyes: recent advances and perspectives, Coloration Technology 129(3), 2013, pp. 173–186.
  • [25] CURTEANU S., CARTWRIGHT H., Neural networks applied in chemistry. I. Determination of the optimal topology of multilayer perceptron neural networks, Journal of Chemometrics 25(10), 2011, pp. 527–549.
  • [26] TETKO I.V., LIVINGSTONE D.J., LUIK A.I., Neural network studies. 1. Comparison of overfitting and overtraining, Journal of Chemical Information and Modeling 35(5), 1995, pp. 826–833.
  • [27] KOKER R., ALTINKOK N., DEMIR A., Neural network based prediction of mechanical properties of particulate reinforced metal matrix composites using various training algorithms, Materials and Design 28(2), 2007, pp. 616–627.
  • [28] DE M BEZERRA C., HAWKYARD C.J., Computer match prediction for fluorescent dyes by neural networks, Coloration Technology 116(5–6), 2000, pp. 163–169.
  • [29] www.tsienlab.ucsd.edu/Documents/REF%20-%20Fluorophore%20Spectra.xls
  • [30] SARKAR K., MOUNIR BEN GHALIA, ZHENHUA WU, BOSE S.C., A neural network model for the numerical prediction of the diameter of electro-spun polyethylene oxide nanofibers, Journal of Materials Processing Technology 209(7), 2009, pp. 3156–3165.
Typ dokumentu
Bibliografia
Identyfikator YADDA
bwmeta1.element.baztech-aa7c3adc-b921-42fa-bd35-cd174886ff83
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