Drug Metabolism Prediction

  • Producent: VCH
  • Oprawa: Twarda
Wysyłka: Niedostępna
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Opis: Drug Metabolism Prediction

The first professional reference on this highly relevant topic, for drug developers, pharmacologists and toxicologists.§§The authors provide more than a systematic overview of computational tools and knowledge bases for drug metabolism research and their underlying principles. They aim to convey their expert knowledge distilled from many years of experience in the field. In addition to the fundamentals, computational approaches and their applications, this volume provides expert accounts of the latest experimental methods for investigating drug metabolism in four dedicated chapters. The authors discuss the most important caveats and common errors to consider when working with experimental data.§§Collating the knowledge gained over the past decade, this practice-oriented guide presents methods not only used in drug development, but also in the development and toxicological assessment of cosmetics, functional foods, agrochemicals, and additives for consumer goods, making it an invaluable reference in a variety of disciplines.PART I: INTRODUCTION§Metabolism in Drug Development§PART II: SOFTWARE, WEB SERVERS AND DATA RESOURCES TO STUDY METABOLISM§Software for Metabolism Prediction§Online Databases and Web Servers for Drug Metabolism Research§PART III: COMPUTATIONAL APPROACHES TO STUDY CYTOCHROME P450 ENZYMES§Structure and Dynamics of Human Drug-Metabolizing Cytochrome P450 Enzymes§Cytochrome P450 Substrate Recognition and Binding§QM/MM Studies of Structure and Reactivity of Cytochrome P450 Enzymes: Methodology and Selected Applications§Computational Free Energy Methods for Ascertaining Ligand Interaction with Metabolizing Enzymes§Experimental Approaches to Analysis of Reactions of Cytochrome P450 Enzymes§PART IV: COMPUTATIONAL APPROACHES TO STUDY SITES AND PRODUCTS OF METABOLISM§Molecular Interaction Fields for Predicting the Sites and Products of Metabolism§Structure-Based Methods for Predicting the Sites and Products of Metabolism§Reactivity-Based Approaches and Machine Learning Methods for Predicting the Sites of Cytochrome P450-Mediated Metabolism§Knowledge-Based Approaches for Predicting the Sites and Products of Metabolism§PART V: COMPUTATIONAL APPROACHES TO STUDY ENZYME INHIBITION AND INDUCTION§Quantitative Structure-Activity Relationship (QSAR) Methods for the Prediction of Substrates, Inhibitors and Inducers of Metabolic Enzymes§Pharmacophore-Based Methods for Predicting the Inhibition and Induction of Metabolic Enzymes§Prediction of Phosphoglycoprotein (P-gp)-Mediated Disposition in Early Drug Discovery§Predicting Toxic Effects of Metabolites§PART VI: EXPERIMENTAL APPROACHES TO STUDY METABOLISM§In vitro Models for Metabolism: Applicability for Research on Food Bioactives§In vitro Approaches to Study Drug-Drug Interactions§Metabolite Detection and Profiling§Index


Szczegóły: Drug Metabolism Prediction

Tytuł: Drug Metabolism Prediction
Producent: VCH
ISBN: 9783527335664
Rok produkcji: 2014
Ilość stron: 536
Oprawa: Twarda
Waga: 1.27 kg


Recenzje: Drug Metabolism Prediction

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Drug Metabolism Prediction

  • Producent: VCH
  • Oprawa: Twarda

The first professional reference on this highly relevant topic, for drug developers, pharmacologists and toxicologists.§§The authors provide more than a systematic overview of computational tools and knowledge bases for drug metabolism research and their underlying principles. They aim to convey their expert knowledge distilled from many years of experience in the field. In addition to the fundamentals, computational approaches and their applications, this volume provides expert accounts of the latest experimental methods for investigating drug metabolism in four dedicated chapters. The authors discuss the most important caveats and common errors to consider when working with experimental data.§§Collating the knowledge gained over the past decade, this practice-oriented guide presents methods not only used in drug development, but also in the development and toxicological assessment of cosmetics, functional foods, agrochemicals, and additives for consumer goods, making it an invaluable reference in a variety of disciplines.PART I: INTRODUCTION§Metabolism in Drug Development§PART II: SOFTWARE, WEB SERVERS AND DATA RESOURCES TO STUDY METABOLISM§Software for Metabolism Prediction§Online Databases and Web Servers for Drug Metabolism Research§PART III: COMPUTATIONAL APPROACHES TO STUDY CYTOCHROME P450 ENZYMES§Structure and Dynamics of Human Drug-Metabolizing Cytochrome P450 Enzymes§Cytochrome P450 Substrate Recognition and Binding§QM/MM Studies of Structure and Reactivity of Cytochrome P450 Enzymes: Methodology and Selected Applications§Computational Free Energy Methods for Ascertaining Ligand Interaction with Metabolizing Enzymes§Experimental Approaches to Analysis of Reactions of Cytochrome P450 Enzymes§PART IV: COMPUTATIONAL APPROACHES TO STUDY SITES AND PRODUCTS OF METABOLISM§Molecular Interaction Fields for Predicting the Sites and Products of Metabolism§Structure-Based Methods for Predicting the Sites and Products of Metabolism§Reactivity-Based Approaches and Machine Learning Methods for Predicting the Sites of Cytochrome P450-Mediated Metabolism§Knowledge-Based Approaches for Predicting the Sites and Products of Metabolism§PART V: COMPUTATIONAL APPROACHES TO STUDY ENZYME INHIBITION AND INDUCTION§Quantitative Structure-Activity Relationship (QSAR) Methods for the Prediction of Substrates, Inhibitors and Inducers of Metabolic Enzymes§Pharmacophore-Based Methods for Predicting the Inhibition and Induction of Metabolic Enzymes§Prediction of Phosphoglycoprotein (P-gp)-Mediated Disposition in Early Drug Discovery§Predicting Toxic Effects of Metabolites§PART VI: EXPERIMENTAL APPROACHES TO STUDY METABOLISM§In vitro Models for Metabolism: Applicability for Research on Food Bioactives§In vitro Approaches to Study Drug-Drug Interactions§Metabolite Detection and Profiling§Index

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Cena 691,01 PLN
Nasza cena 646,09 PLN
Oszczędzasz 6%
Wysyłka: Niedostępna
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Szczegóły: Drug Metabolism Prediction

Tytuł: Drug Metabolism Prediction
Producent: VCH
ISBN: 9783527335664
Rok produkcji: 2014
Ilość stron: 536
Oprawa: Twarda
Waga: 1.27 kg


Recenzje: Drug Metabolism Prediction

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