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Advances in Molecular Simulation

Molecular simulations are commonly used in physics, chemistry, biology, material science, engineering, and even medicine. This book provides a wide range of molecular simulation methods and their applications in various fields. It reflects the power of molecular simulation as an effective research t...

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Bibliographic Details
Main Author: Borówko, Małgorzata
Format: eBook
Language:English
Published: Basel, Switzerland MDPI - Multidisciplinary Digital Publishing Institute 2021
Subjects:
Biomolecular Solvation
Sampling
Water Transport
Force Field
Antibody
Crystallization
Time-dependent Schrödinger Equation
Gemini
Drag Reduction
Local Free Energy Landscape
Laser-matter Interaction
Spectral Properties Of Rhodopsins
Antimicrobial
Surfactant Molecules
N/a
Molecular Dynamics Simulation
Phase Transitions
Coarse Graining
Dft
Colloids With Competing Interactions
Molecular Dynamics
Membranes
Multiscale
Mutation
Time-dependent Unitary Transformation Method
Biomolecular Simulation
Nanocomposites
Main Protease
Monte Carlo
Toll-like Receptor
Self-assembly
Photobiology
Packing
3cl Protease
Atomistic Simulation
Three-dimensional Reference Interaction Site Model
Rhodopsins
Technology: General Issues / Bicssc
Cluster
Multiple Time Step Md
Compartment
Periodic Microphases
Graphene
Sars-cov-2
Carbon Nanotube
Covid-19
Force Fields
Local Sampling
Phase Transition
Computer Simulations
Extreme Conditions
Castep
Numerical Method
Osmolyte
Atomic Structure
Aimd
Coarse-grained Molecular Simulation
Pf-07321332
Parametrisation
Confinement
Biological Photosensors
Hard Sphere
Nanocarriers
Proton Transport
Hairy Nanoparticles
Kramers-henneberger Frame
Gpu Programming
Molecular Simulation
Molecular Solvation Theory
Janus Particles
Polymorphism
Adsorption On Nanoparticles
Osmosis
Generalized Solvation Free Energy
Dna Damage
Kovalenko-hirata Closure
α-ketoamide
Ab Initio Molecular Dynamics
Molecular Modeling
Nanochannel
Protein-ligand Binding
Strong-field Ionization
Engineering Of Red-shifted Rhodopsins
Epitope
Semi-flexible Polymers
Spectral Tuning In Rhodopsins
Monte Carlo Simulation
Neural Network
Many Body Interactions
Order Parameter
Online Access:
Collection: Directory of Open Access Books - Collection details see MPG.ReNa
Description
Summary:Molecular simulations are commonly used in physics, chemistry, biology, material science, engineering, and even medicine. This book provides a wide range of molecular simulation methods and their applications in various fields. It reflects the power of molecular simulation as an effective research tool. We hope that the presented results can provide an impetus for further fruitful studies.
Item Description:Creative Commons (cc), https://creativecommons.org/licenses/by/4.0/
Physical Description:1 electronic resource (288 p.)
ISBN:9783036527109
9783036527116
books978-3-0365-2711-6

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