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Book Categories |
| Preface to the Second Edition | ||
| Preface to the First Edition | ||
| Symbols and Physical Constants | ||
| Acknowledgements | ||
| 1 | Useful Concepts in Molecular Modelling | 1 |
| 2 | An Introduction to Computational Quantum Mechanics | 26 |
| 3 | Advanced ab initio Methods, Density Functional Theory and Solid-state Quantum Mechanics | 108 |
| 4 | Empirical Force Field Models: Molecular Mechanics | 165 |
| 5 | Energy Minimisation and Related Methods for Exploring the Energy Surface | 253 |
| 6 | Computer Simulation Methods | 303 |
| 7 | Molecular Dynamics Simulation Methods | 353 |
| 8 | Monte Carlo Simulation Methods | 410 |
| 9 | Conformational Analysis | 457 |
| 10 | Protein Structure Prediction, Sequence Analysis and Protein Folding | 509 |
| 11 | Four Challenges in Molecular Modelling: Free Energies, Solvation, Reactions and Solid-state Defects | 563 |
| 12 | The Use of Molecular Modelling and Chemoinformatics to Discover and Design New Molecules | 640 |
| Index | 727 |
| Price | Condition | Delivery | Seller | Action |
| $126.26 | Digital |
| WonderClub |
Monte Broughton
reviewed Molecular Modelling: Principles and Applications on June 02, 2016 Molecular Modelling
Although this book covers almost all topics from molecular modelling, and has some insides to physics and math along with simple calculation examples I wouldn't recommend it to a beginner. Despite of easy language and seemingly all necessary material, the book doesn't give deep understanding. Topics and examples are placed quite chaotically and not consequently.
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Add Molecular Modelling: Principles and Applications, This important new edition is for postgraduate students of Chemistry, Medicinal Chemistry and Biochemistry studying Molecular Modelling and Computational Chemistry. The book will also be useful to researchers in academia and in the pharmaceutical and chem, Molecular Modelling: Principles and Applications to the inventory that you are selling on WonderClubX
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Add Molecular Modelling: Principles and Applications, This important new edition is for postgraduate students of Chemistry, Medicinal Chemistry and Biochemistry studying Molecular Modelling and Computational Chemistry. The book will also be useful to researchers in academia and in the pharmaceutical and chem, Molecular Modelling: Principles and Applications to your collection on WonderClub |