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Paperback Carbon Nanotubes as Nanodelivery Systems: An Insight Through Molecular Dynamics Simulations Book
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ISBN: 981445138X

ISBN13: 9789814451383

Carbon Nanotubes as Nanodelivery Systems: An Insight Through Molecular Dynamics Simulations

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CHAPTER 1 Introduction

1.1 Background

1.2 Bibliography

CHAPTER 2 Building an MD simulation program

2.1 Introduction

2.2 Ensembles

2.3 Periodic Boundary Conditions

2.4 Neighbour list

2.5 Potential energy and forces

2.6 The velocity Verlet method

2.7 Simulation algorithm

2.8 Bibliography

CHAPTER 3 Sample of an application of an MD simulation...

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