Molecular mechanics and modeling /

Detalles Bibliográficos
Clasificación:Libro Electrónico
Otros Autores: Watkins, Priscilla (Editor )
Formato: Electrónico eBook
Idioma:Inglés
Publicado: New York : Nova Science Publishers, Inc., [2015]
Colección:Chemistry research and applications series.
Temas:
Chemistry, Technical.
Chemical engineering.
Finite element method.
Nanostructured materials.
Chimie industrielle.
Génie chimique.
Méthode des éléments finis.
Nanomatériaux.
chemical engineering.
SCIENCE > Chemistry > Industrial & Technical.
TECHNOLOGY & ENGINEERING > Chemical & Biochemical.
Chemical engineering
Chemistry, Technical
Finite element method
Nanostructured materials
Acceso en línea:Texto completo
Tabla de Contenidos:
  • MOLECULAR MECHANICS AND MODELING; MOLECULAR MECHANICS AND MODELING; Library of Congress Cataloging-in-Publication Data; CONTENTS; PREFACE; Chapter 1: FINITE ELEMENT BASED MULTISCALE MODELING USING THE BRIDGING CELL METHOD; ABSTRACT; 1. INTRODUCTION; 2. REVIEW OF CONCURRENT MULTISCALE METHODS; 3. EXISTING ISSUES; 4. BRIDGING CELL METHOD; 5. PERFORMANCE TESTS; 6. FUTURE DIRECTIONS; CONCLUSION; REFERENCES; Chapter 2: BASIC PROPERTIES OF A MOLECULAR MECHANICS PROGRAM AND THE GENERATION OF UNKNOWN STEREO STRUCTURES OF PROTEINS FOR QUANTITATIVE ANALYSIS OF ENZYME REACTIONS; ABSTRACT; INTRODUCTION
  • EXPERIMENTALRESULTS AND DISCUSSION; CONCLUSION; REFERENCES; Chapter 3: QUANTITATIVE IN SILICO ANALYSIS OF ALANINE RACEMASE REACTIVITY; ABSTRACT; INTRODUCTION; EXPERIMENTAL; CONCLUSION; ACKNOWLEDGMENT; REFERENCES; Chapter 4: GRAPHENE LAYER PORE MODELS FOR MOLECULE-SURFACE BINDING ENERGIES; ABSTRACT; 1. INTRODUCTION; 2. THEORY; 3. EXPERIMENT; 4. ANALYSIS AND RESULTS; 5. DISCUSSION; CONCLUSION; ACKNOWLEDGMENT; REFERENCES; INDEX

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