Quantitative Structure-activity Relationship

The book, which is related to QSAR in sciences, is divided into five main chapters. The first chapter is the Introductory chapter. The second chapter aims to provide an update of the recent advances in the field of rational design of PDE inhibitors. The third chapter includes designing a series of p...

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Jezik:engleski
Izdano: IntechOpen 2023
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collection Directory of Open Access Books
description The book, which is related to QSAR in sciences, is divided into five main chapters. The first chapter is the Introductory chapter. The second chapter aims to provide an update of the recent advances in the field of rational design of PDE inhibitors. The third chapter includes designing a series of peptidic inhibitors that possessed a substrate transition-state analog and evaluating the structure-activity relationship of the designed inhibitors, based on docking and scoring, using the docking simulation software Molecular Operating Environment. The aim of the forth chapter is to develop structure-property relationships for the qualitative and quantitative prediction of the reverse-phase liquid chromatographic retention times of chlorogenic acids. The final chapter aims to determine the model of interactions between the natural compounds with anti-inflammatory molecular target by molecular docking analysis.
format Online
id doab-20.500.12854ir-129478
institution Directory of Open Access Books
language eng
publishDate 2023
publishDateRange 2023
publishDateSort 2023
publisher IntechOpen
publisherStr IntechOpen
record_format ojs
spelling doab-20.500.12854ir-1294782024-04-05T17:30:44Z Quantitative Structure-activity Relationship Kandemirli, Fatma alzheimer’s disease, molecular dynamics, anti-inflammatory, fractal dimension, natural compounds, coffee thema EDItEUR::P Mathematics and Science::PS Biology, life sciences::PSB Biochemistry The book, which is related to QSAR in sciences, is divided into five main chapters. The first chapter is the Introductory chapter. The second chapter aims to provide an update of the recent advances in the field of rational design of PDE inhibitors. The third chapter includes designing a series of peptidic inhibitors that possessed a substrate transition-state analog and evaluating the structure-activity relationship of the designed inhibitors, based on docking and scoring, using the docking simulation software Molecular Operating Environment. The aim of the forth chapter is to develop structure-property relationships for the qualitative and quantitative prediction of the reverse-phase liquid chromatographic retention times of chlorogenic acids. The final chapter aims to determine the model of interactions between the natural compounds with anti-inflammatory molecular target by molecular docking analysis. 2023-12-01T15:29:48Z 2023-12-01T15:29:48Z 2017 book ONIX_20231201_9789535134107_587 9789535134107 9789535134091 9789535146803 https://directory.doabooks.org/handle/20.500.12854/129478 eng image/jpeg n/a https://www.intechopen.com/books/5843 https://mts.intechopen.com/storage/books/5843/authors_book/authors_book.pdf IntechOpen IntechOpen 10.5772/65597 10.5772/65597 78a36484-2c0c-47cb-ad67-2b9f5cd4a8f6 9789535134107 9789535134091 9789535146803 IntechOpen 88 open access
spellingShingle alzheimer’s disease, molecular dynamics, anti-inflammatory, fractal dimension, natural compounds, coffee
thema EDItEUR::P Mathematics and Science::PS Biology, life sciences::PSB Biochemistry
Quantitative Structure-activity Relationship
title Quantitative Structure-activity Relationship
title_full Quantitative Structure-activity Relationship
title_fullStr Quantitative Structure-activity Relationship
title_full_unstemmed Quantitative Structure-activity Relationship
title_short Quantitative Structure-activity Relationship
title_sort quantitative structure activity relationship
topic alzheimer’s disease, molecular dynamics, anti-inflammatory, fractal dimension, natural compounds, coffee
thema EDItEUR::P Mathematics and Science::PS Biology, life sciences::PSB Biochemistry
topic_facet alzheimer’s disease, molecular dynamics, anti-inflammatory, fractal dimension, natural compounds, coffee
thema EDItEUR::P Mathematics and Science::PS Biology, life sciences::PSB Biochemistry
url ONIX_20231201_9789535134107_587