Molecular Dynamics

1 Open Access Books

31 Authors and Editors

54 Web of Science Citations

58 Dimensions Citations

1 peer-reviewed open access book

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1. MM-GB(PB)SA Calculations of Protein-Ligand Binding Free Energies

By Joseph M. Hayes and Georgios Archontis

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

2. M.DynaMix Studies of Solvation, Solubility and Permeability

By Aatto Laaksonen, Alexander Lyubartsev and Francesca Mocci

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

3. Molecular Dynamics Simulation of Synthetic Polymers

By Claudia Sandoval

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

4. Practical Estimation of TCR-pMHC Binding Free-Energy Based on the Dielectric Model and the Coarse-Grained Model

By Hiromichi Tsurui and Takuya Takahashi

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

5. Micro-Heterogeneity in Complex Liquids

By Aurélien Perera, Bernarda Kežić, Franjo Sokolić and Larisa Zoranić

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

6. Essential Dynamics on Different Biological Systems: Fis Protein, tvMyb1 Transcriptional Factor and BACE1 Enzyme

By Lucas J. Gutiérrez, Ricardo D. Enriz and Héctor A. Baldoni

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

7. Simulations of Unusual Properties of Water Inside Carbon Nanotubes

By Yoshimichi Nakamura and Takahisa Ohno

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

8. Backbone Connectivity and Collective Aggregation Phenomena in Polymer Systems

By Wen-Jong Ma and Chin-Kun Hu

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

9. Application of Molecular Dynamics Simulations to Plasma Etch Damage in Advanced Metal-Oxide-Semiconductor Field-Effect Transistors

By Koji Eriguchi

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules

10. Applications of All-Atom Molecular Dynamics to Nanofluidics

By Mauro Chinappi

Part of book: Molecular Dynamics - Studies of Synthetic and Biological Macromolecules