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Record Nr. |
UNINA9910830701103321 |
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Titolo |
Continuum scale simulation of engineering materials [[electronic resource] ] : fundamentals, microstructures, process applications / / edited by Dierk Raabe ... [et al.] |
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Pubbl/distr/stampa |
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Weinheim, : Wiley-VCH |
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Chichester, : John Wiley, 2004 |
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ISBN |
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1-280-51961-4 |
9786610519613 |
3-527-60378-6 |
3-527-60421-9 |
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Descrizione fisica |
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1 online resource (889 p.) |
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Altri autori (Persone) |
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Disciplina |
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Soggetti |
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Materials - Computer simulation |
Manufacturing processes - Computer simulation |
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Lingua di pubblicazione |
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Formato |
Materiale a stampa |
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Livello bibliografico |
Monografia |
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Note generali |
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Description based upon print version of record. |
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Nota di bibliografia |
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Includes bibliographical references and index. |
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Nota di contenuto |
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Continuum Scale Simulation of Engineering Materials; Contents; Preface; List of Contributors; I Fundamentals and Basic Methods; 1 Computer Simulation of Diffusion Controlled Phase Transformations; 1.1 Introduction; 1.2 Numerical Treatment of Diffusion Controlled Transformations; 1.2.1 Diffusion; 1.2.2 Boundary Conditions; 1.2.3 Cell Size; 1.3 Typical Applications; 1.3.1 LE, LENP and PE in Fe-Mn-C; 1.3.2 LE, LENP and PE in Fe-Si-C; 1.3.3 PE in Fe-Ni-C; 1.3.4 Effect of Traces on the Growth of Grain Boundary Cementite; 1.3.5 Continuous Cooling |
1.3.6 Competitive Growth of Phases: Multi-Cell Calculations1.3.7 Gas-Metal-Reactions: Carburization; 1.4 Outlook; References; 2 Introduction to the Phase-Field Method of Microstructure Evolution; 2.1 Introduction; 2.2 Origin of the Model; 2.3 Theoretical Fundamentals of the Method; 2.3.1 Representation of a Microstructure; 2.3.2 Thermodynamics of Microstructures; 2.3.3 The Evolution Equations; 2.4 Advantages and Disadvantages of the Method; 2.5 Typical Fields of Applications and Examples; 2.6 Summary and Opportunities; References; 3 Cellular, Lattice Gas, and Boltzmann Automata |
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3.1 Cellular Automata3.1.1 Introduction; 3.1.2 Formal Description and Classes of Cellular Automata; 3.1.3 Cellular Automata in Materials Science; 3.1.4 Recrystallization Simulations with Cellular Automata; 3.2 Cellular Automata for Fluid Dynamics; 3.2.1 Introduction; 3.2.2 The HPP and FHP Lattice Gas Cellular Automata; 3.2.3 The Lattice Boltzmann Automaton; 3.3 Conclusions and Outlook; References; 4 The Monte Carlo Method; 4.1 Introduction; 4.2 History of the Monte Carlo Method; 4.2.1 Ising and Potts Models; 4.2.2 Metropolis Algorithm; 4.2.3 n-fold Way Algorithm |
4.3 Description of the Monte Carlo Method for Grain Growth & Recrystallization4.3.1 Discretization of Microstructure; 4.3.2 Evolution of the Microstructure; 4.3.3 Inert Particles; 4.3.4 Lattices; 4.3.5 Boundary Conditions; 4.3.6 Parallelization of the Monte Carlo Algorithm; 4.4 Nucleation in Recrystallization; 4.5 Initialization of MC Simulations; 4.6 Verification of the Monte Carlo Model; 4.7 Scaling of Simulated Grain Size to Physical Grain Size; 4.8 Recrystallization Kinetics in the Monte Carlo model; 4.9 Results of Simulation of Recrystallization by Monte Carlo Method |
4.9.1 Abnormal Grain Growth4.9.2 Static Recrystallization; 4.9.3 Grain Growth in the Presence of Particles; 4.9.4 Recrystallization in the Presence of Particles; 4.9.5 Texture Development; 4.9.6 Texture; 4.9.7 Dynamic Recrystallization; 4.10 Summary; References; 5 Crystal Plasticity; 5.1 Introduction; 5.2 Theoretical Background; 5.2.1 Mechanical Response of Single Crystals; 5.2.2 Lattice Orientation Distributions for Polycrystals; 5.2.3 Mechanical Response of Polycrystals; 5.3 Macroscopic Criteria for Anisotropic Strength; 5.3.1 Generalities; 5.3.2 Yield Surfaces Defined by Expansions |
5.3.3 Yield Surfaces Defined by Hyperplanes |
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Sommario/riassunto |
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This book fills a gap by presenting our current knowledge and understanding of continuum-based concepts behind computational methods used for microstructure and process simulation of engineering materials above the atomic scale. The volume provides an excellent overview on the different methods, comparing the different methods in terms of their respective particular weaknesses and advantages. This trains readers to identify appropriate approaches to the new challenges that emerge every day in this exciting domain. Divided into three main parts, the first is a basic overview covering fu |
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2. |
Record Nr. |
UNINA9910811243903321 |
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Titolo |
GPCR molecular pharmacology and drug targeting : shifting paradigms and new directions / / edited by Annette Gilchrist |
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Pubbl/distr/stampa |
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Hoboken, N.J., : Wiley, c2010 |
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ISBN |
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9786612685996 |
9781118035177 |
1118035178 |
9781282685994 |
1282685996 |
9780470627327 |
0470627328 |
9780470627310 |
047062731X |
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Edizione |
[1st ed.] |
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Descrizione fisica |
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1 online resource (544 p.) |
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Altri autori (Persone) |
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Disciplina |
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Soggetti |
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G proteins |
Drug targeting |
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Lingua di pubblicazione |
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Formato |
Materiale a stampa |
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Livello bibliografico |
Monografia |
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Note generali |
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Nota di contenuto |
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GPCR MOLECULAR PHARMACOLOGY AND DRUG TARGETING: SHIFTING PARADIGMS AND NEW DIRECTIONS; CONTENTS; PREFACE; CONTRIBUTORS; CHAPTER 1: The Evolution of Receptors: From On-Off Switches to Microprocessors; CHAPTER 2: The Evolving Pharmacology of GPCRs; CHAPTER 3: The Emergence of Allosteric Modulators for G Protein - Coupled Receptors; CHAPTER 4: Receptor-Mediated G Protein Activation: How, How Many, and Where?; CHAPTER 5: Molecular Pharmacology of Frizzleds-with Implications for Possible Therapy |
CHAPTER 6: Secretin Receptor Dimerization: A Possible Functionally Important Paradigm for Family B G Protein-Coupled ReceptorsCHAPTER 7: Past and Future Strategies for GPCR Deorphanization; CHAPTER 8: High-Throughput GPCR Screening Technologies and the Emerging Importance of the Cell Phenotype; CHAPTER 9: Are "Traditional" Biochemical Techniques Out of Fashion in the New Era of GPCR |
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Pharmacology?; CHAPTER 10: Fluorescence and Resonance Energy Transfer Shine New Light on GPCR Function; CHAPTER 11: Integration of Label-Free Detection Methods in GPCR Drug Discovery |
CHAPTER 12: Screening for Allosteric Modulators of G Protein-Coupled ReceptorsCHAPTER 13: Ultra-High-Throughput Screening Assays for GPCRs; CHAPTER 14: New Techniques to Express and Crystallize G Protein-Coupled Receptors; CHAPTER 15: Structure and Modeling of GPCRs: Implications for Drug Discovery; CHAPTER 16: X-Ray Structure Developments for GPCR Drug Targets; CHAPTER 17: Pharmacological Chaperones: Potential for the Treatment of Hereditary Diseases Caused by Mutations in G Protein-Coupled Receptors; INDEX |
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Sommario/riassunto |
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G protein-coupled receptors (GPCRs) are a large protein family of transmembrane receptors vital in dictating cellular responses. GPCRs are involved in many diseases, but are also the target of around half of all modern medicinal drugs. Shifting Paradigms in G Protein Coupled Receptors takes a look at the way GPCRs are examined today, how they react, how their mutations lead to disease, and the many ways in which they can be screened for compounds that modulate them. Chemists, pharmacologists, and biologists will find essential information in this comprehensive reference. |
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