Chapter 8 Computational Modelling of the Steps Involved in Photodynamic Therapy

Photodynamic therapy (PDT) is a branch of phototherapy that has seen a surge of interest in the last few decades, due to its potential in the treatment of various cancers, infections and heart disease.(Bonnett, 2000) This chapter aims to give an overview of the various photochemical steps invo...

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Główni autorzy: Paterson, Martin J., Bergendahl, L. Therese
Format: Online
Język:angielski
Wydane: InTechOpen 2021
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author Paterson, Martin J.
Bergendahl, L. Therese
author_browse Bergendahl, L. Therese
Paterson, Martin J.
author_facet Paterson, Martin J.
Bergendahl, L. Therese
author_sort Paterson, Martin J.
collection Directory of Open Access Books
description Photodynamic therapy (PDT) is a branch of phototherapy that has seen a surge of interest in the last few decades, due to its potential in the treatment of various cancers, infections and heart disease.(Bonnett, 2000) This chapter aims to give an overview of the various photochemical steps involved in PDT as a cancer therapy, and in particular the challenges and insight gained from their theoretical description. After a brief review of PDT in general, in a biological and chemical context, the photochemical steps involved will be discussed, detailing the computational techniques required to model these chemical pathways theoretically. We will detail the methodologies that can currently be applied, as well as their limitations of use at present, and areas requiring further development.
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spelling doab-20.500.12854ir-322422025-05-08T09:54:35Z Chapter 8 Computational Modelling of the Steps Involved in Photodynamic Therapy Paterson, Martin J. Bergendahl, L. Therese computational modelling photodynamic therapy computational modelling photodynamic therapy Electron Excited state Ground state Molecule Multi-configurational self-consistent field Pacific Time Zone Photosensitizer Porphyrin Wave function Photodynamic therapy (PDT) is a branch of phototherapy that has seen a surge of interest in the last few decades, due to its potential in the treatment of various cancers, infections and heart disease.(Bonnett, 2000) This chapter aims to give an overview of the various photochemical steps involved in PDT as a cancer therapy, and in particular the challenges and insight gained from their theoretical description. After a brief review of PDT in general, in a biological and chemical context, the photochemical steps involved will be discussed, detailing the computational techniques required to model these chemical pathways theoretically. We will detail the methodologies that can currently be applied, as well as their limitations of use at present, and areas requiring further development. 2021-02-10T12:58:18Z 2019-10-04 14:33:32 2020-04-01T14:06:53Z 2016-08-01 23:55 2019-10-04 14:33:32 2020-04-01T14:06:53Z 2016-12-31 23:55:55 2019-10-04 14:33:32 2020-04-01T14:06:53Z 2012 chapter 612605 OCN: 1030819927 http://library.oapen.org/handle/20.500.12657/32338 https://directory.doabooks.org/handle/20.500.12854/32242 eng open access image/jpeg image/jpeg image/jpeg image/jpeg image/jpeg n/a n/a n/a n/a n/a https://library.oapen.org/bitstream/20.500.12657/32338/1/612605.pdf https://library.oapen.org/bitstream/20.500.12657/32338/1/612605.pdf https://library.oapen.org/bitstream/20.500.12657/32338/1/612605.pdf https://library.oapen.org/bitstream/20.500.12657/32338/1/612605.pdf https://library.oapen.org/bitstream/20.500.12657/32338/1/612605.pdf InTechOpen 10.5772/37654 10.5772/37654 035ecc65-6737-43cf-a13a-6bdf67ce01f4 Molecular Photochemistry - Various Aspects FP7 Ideas: European Research Council 7292b17b-f01a-4016-94d3-d7fb5ef9fb79 European Research Council (ERC) EU collection 258990 FP7 open access
spellingShingle computational modelling
photodynamic therapy
computational modelling
photodynamic therapy
Electron
Excited state
Ground state
Molecule
Multi-configurational self-consistent field
Pacific Time Zone
Photosensitizer
Porphyrin
Wave function
Paterson, Martin J.
Bergendahl, L. Therese
Chapter 8 Computational Modelling of the Steps Involved in Photodynamic Therapy
title Chapter 8 Computational Modelling of the Steps Involved in Photodynamic Therapy
title_full Chapter 8 Computational Modelling of the Steps Involved in Photodynamic Therapy
title_fullStr Chapter 8 Computational Modelling of the Steps Involved in Photodynamic Therapy
title_full_unstemmed Chapter 8 Computational Modelling of the Steps Involved in Photodynamic Therapy
title_short Chapter 8 Computational Modelling of the Steps Involved in Photodynamic Therapy
title_sort chapter 8 computational modelling of the steps involved in photodynamic therapy
topic computational modelling
photodynamic therapy
computational modelling
photodynamic therapy
Electron
Excited state
Ground state
Molecule
Multi-configurational self-consistent field
Pacific Time Zone
Photosensitizer
Porphyrin
Wave function
topic_facet computational modelling
photodynamic therapy
computational modelling
photodynamic therapy
Electron
Excited state
Ground state
Molecule
Multi-configurational self-consistent field
Pacific Time Zone
Photosensitizer
Porphyrin
Wave function
url 612605
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