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Molecular modeling of proteins

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Cover of 'Molecular modeling of proteins'

Table of Contents

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    Book Overview
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    Chapter 1 Molecular Dynamics Simulations
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    Chapter 2 Monte Carlo Simulations
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    Chapter 3 Hybrid Quantum and Classical Methods for Computing Kinetic Isotope Effects of Chemical Reactions in Solutions and in Enzymes
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    Chapter 4 Comparison of Protein Force Fields for Molecular Dynamics Simulations
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    Chapter 5 Normal Modes and Essential Dynamics
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    Chapter 6 Calculation of Absolute Protein–Ligand Binding Constants with the Molecular Dynamics Free Energy Perturbation Method
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    Chapter 7 Free Energy Calculations Applied to Membrane Proteins
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    Chapter 8 Molecular dynamics simulations of membrane proteins.
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    Chapter 9 Membrane-Associated Proteins and Peptides
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    Chapter 10 Implicit Membrane Models for Membrane Protein Simulation
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    Chapter 11 Comparative Modeling of Proteins
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    Chapter 12 Transmembrane Protein Models Based on High-Throughput Molecular Dynamics Simulations with Experimental Constraints
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    Chapter 13 Nuclear Magnetic Resonance-Based Modeling and Refinement of Protein Three-Dimensional Structures and Their Complexes
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    Chapter 14 Conformational Changes in Protein Function
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    Chapter 15 Protein Folding and Unfolding by All-Atom Molecular Dynamics Simulations
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    Chapter 16 Modeling of Protein Misfolding in Disease
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    Chapter 17 Identifying Putative Drug Targets and Potential Drug Leads
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    Chapter 18 Receptor Flexibility for Large-Scale In Silico Ligand Screens
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    Chapter 19 Molecular Docking
Attention for Chapter 1: Molecular Dynamics Simulations
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Citations

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Chapter title
Molecular Dynamics Simulations
Chapter number 1
Book title
Molecular Modeling of Proteins
Published by
Humana Press, January 2008
DOI 10.1007/978-1-59745-177-2_1
Pubmed ID
Book ISBNs
978-1-58829-864-5, 978-1-59745-177-2
Authors

Erik R. Lindahl, Lindahl, Erik R.

Mendeley readers

The data shown below were compiled from readership statistics for 185 Mendeley readers of this research output. Click here to see the associated Mendeley record.

Geographical breakdown

Country Count As %
United States 3 2%
Germany 2 1%
Canada 2 1%
United Kingdom 2 1%
Brazil 1 <1%
Iran, Islamic Republic of 1 <1%
Sweden 1 <1%
Unknown 173 94%

Demographic breakdown

Readers by professional status Count As %
Student > Master 31 17%
Student > Ph. D. Student 30 16%
Student > Bachelor 29 16%
Researcher 21 11%
Student > Doctoral Student 14 8%
Other 30 16%
Unknown 30 16%
Readers by discipline Count As %
Chemistry 39 21%
Agricultural and Biological Sciences 34 18%
Biochemistry, Genetics and Molecular Biology 24 13%
Physics and Astronomy 10 5%
Engineering 8 4%
Other 34 18%
Unknown 36 19%