Computer modeling to optimize the sensitivity of an optical DNA nanosensor

This paper describes how the sensitivity of an optical DNA nanosensor based on MNPs and QDs was enhanced by using computer simulations including an innovative software, Grasshopper. The data used was derived from a previously constructed mechanism which, although successful in detecting target DNA q...

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Main Authors: Hushiarian, Roozbeh, Yusof, Nor Azah, Houshiarian, Negin, Abdullah, Abdul Halim, Alang Ahmad, Shahrul Ainliah
Format: Article
Published: Elsevier 2015
Online Access:http://psasir.upm.edu.my/id/eprint/44155/
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author Hushiarian, Roozbeh
Yusof, Nor Azah
Houshiarian, Negin
Abdullah, Abdul Halim
Alang Ahmad, Shahrul Ainliah
author_facet Hushiarian, Roozbeh
Yusof, Nor Azah
Houshiarian, Negin
Abdullah, Abdul Halim
Alang Ahmad, Shahrul Ainliah
author_sort Hushiarian, Roozbeh
building UPM Institutional Repository
collection Online Access
description This paper describes how the sensitivity of an optical DNA nanosensor based on MNPs and QDs was enhanced by using computer simulations including an innovative software, Grasshopper. The data used was derived from a previously constructed mechanism which, although successful in detecting target DNA qualitatively, raised some areas for further investigation. By adjusting the relative proportions of DNA probes, MNPs and QDs in the model, we were able to simulate a range of different reactions in the sensor and to measure them quantitatively. We were able to observe MNPs and QDs binding to more than one strand of DNA and to better understand how they network in different concentrations of the solution. We found a direct correlation coefficient of 0.9666 between the fluorescent intensity of the CdSe/ZnS QDs and the concentration of tDNA within the range of 1 × 10−6–3.9 × 10−9 M. To optimize the sensor further, we also modified the hybridization procedure, breaking it into two steps. This produced a very satisfactory LOD calculation of 1.75 × 10−9 M. Finally, when we applied the 2 step hybridization procedure we were able to improve the sensitivity of the optical nanosensor up to 20% furthur.
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institution Universiti Putra Malaysia
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publishDate 2015
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spelling upm-441552023-12-25T12:12:14Z http://psasir.upm.edu.my/id/eprint/44155/ Computer modeling to optimize the sensitivity of an optical DNA nanosensor Hushiarian, Roozbeh Yusof, Nor Azah Houshiarian, Negin Abdullah, Abdul Halim Alang Ahmad, Shahrul Ainliah This paper describes how the sensitivity of an optical DNA nanosensor based on MNPs and QDs was enhanced by using computer simulations including an innovative software, Grasshopper. The data used was derived from a previously constructed mechanism which, although successful in detecting target DNA qualitatively, raised some areas for further investigation. By adjusting the relative proportions of DNA probes, MNPs and QDs in the model, we were able to simulate a range of different reactions in the sensor and to measure them quantitatively. We were able to observe MNPs and QDs binding to more than one strand of DNA and to better understand how they network in different concentrations of the solution. We found a direct correlation coefficient of 0.9666 between the fluorescent intensity of the CdSe/ZnS QDs and the concentration of tDNA within the range of 1 × 10−6–3.9 × 10−9 M. To optimize the sensor further, we also modified the hybridization procedure, breaking it into two steps. This produced a very satisfactory LOD calculation of 1.75 × 10−9 M. Finally, when we applied the 2 step hybridization procedure we were able to improve the sensitivity of the optical nanosensor up to 20% furthur. Elsevier 2015 Article PeerReviewed Hushiarian, Roozbeh and Yusof, Nor Azah and Houshiarian, Negin and Abdullah, Abdul Halim and Alang Ahmad, Shahrul Ainliah (2015) Computer modeling to optimize the sensitivity of an optical DNA nanosensor. Sensors and Actuators B: Chemical, 207 (pt. A). pp. 716-723. ISSN 0925-4005; ESSN: 1873-3077 https://www.sciencedirect.com/science/article/pii/S0925400514012295 10.1016/j.snb.2014.09.120
spellingShingle Hushiarian, Roozbeh
Yusof, Nor Azah
Houshiarian, Negin
Abdullah, Abdul Halim
Alang Ahmad, Shahrul Ainliah
Computer modeling to optimize the sensitivity of an optical DNA nanosensor
title Computer modeling to optimize the sensitivity of an optical DNA nanosensor
title_full Computer modeling to optimize the sensitivity of an optical DNA nanosensor
title_fullStr Computer modeling to optimize the sensitivity of an optical DNA nanosensor
title_full_unstemmed Computer modeling to optimize the sensitivity of an optical DNA nanosensor
title_short Computer modeling to optimize the sensitivity of an optical DNA nanosensor
title_sort computer modeling to optimize the sensitivity of an optical dna nanosensor
url http://psasir.upm.edu.my/id/eprint/44155/
http://psasir.upm.edu.my/id/eprint/44155/
http://psasir.upm.edu.my/id/eprint/44155/