Molecular Dynamics – alle Bücher

Ruben Santamaria
Molecular Dynamics

This molecular dynamics textbook takes the reader from classical mechanics to quantum mechanics and vice versa, and from few-body systems to many-body systems. It is self-contained, comprehensive, and bui…

lieferbar innerhalb 2-3 Wochen

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David A. Micha
Quantum Molecular Dynamics

Molecular Collisions and Gaseous Kinetics presents concepts, theory, and computational approaches to provide a modern treatment of molecular collisions, transport phenomena, and relaxation of importance i…

lieferbar ab 31.12.2025.

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Peter V Coveney, Shunzhou Wan
Molecular Dynamics: Probability and Uncertainty

Embark on a fascinating exploration of molecular dynamics, which combines the authors' new probabilistic interpretation with cutting-edge simulations, some of which are performed on the largest supercompu…

lieferbar innerhalb 1-2 Wochen

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Jiapu Zhang
Optimization-based Molecular Dynamics Studies of SARS-CoV-2 Molecular Structures

COVID-19 has brought us extensive research databases in the fields of biophysics, biology, and bioinformatics. To extract valuable structural bioinformatic information of SARS-CoV-2 structural and nonstru…

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Niels E Henriksen, Flemming Y Hansen
Theories of Molecular Reaction Dynamics

This book describes how chemical reactions take place at the atomic level and how one can calculate the rate of such reactions. The book features a systematic and comprehensive presentation of the subject…

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José Joaquim Costa Cruz Pinto, José Reinas Dos Santos André
Costa Cruz Pinto, J: Analytical Molecular Dynamics of Amorph

The book provides a detailed quantitative study and characterization of the physics of the thermal and viscoelastic behavior of mainly amorphous materials, and addresses a readership of both undergraduate…

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Fattouche Maroua, Belaidi Salah
Design of new selective inhibitors of HCV NS5B

In this study, a QSAR investigation was carried out on a set of thirty-eight isothiazole derivatives targeting NS5B inhibition and thus the treatment of hepatitis C virus (HCV). The research methodology u…

lieferbar innerhalb 2-3 Wochen

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Hauke Paulsen
Molekulardynamik

Dieses Lehrbuch führt ein in die computergestützte Methode die Wechselwirkungen zwischen Atomen und Molekülen durch empirische Potentiale zu beschreiben und deren Dynamik zu berechnen.Besonderheiten : Mit…

lieferbar ab 9.10.2025.

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Structure-Based Drug Design

This volume focuses on target-oriented approximations to drug discovery, including target selection, binding pocket detection, and current uses and variants of molecular dynamics and molecular docking. Th…

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Computational Intelligence in Drug Development

This book offers a comprehensive overview of cutting-edge computational strategies in drug discovery, with a focus on in silico approaches that accelerate the identification and optimization of therapeuti…

lieferbar ab 13.12.2025.

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Klavs Hansen
Statistical Physics of Nanoparticles in the Gas Phase

Introduction.- The relation between classical and quantum statistics.- Microcanonical temperature.- Thermal properties of vibrations.- Rate constants for emission of atoms and electrons.- Kinetic energy r…

lieferbar innerhalb 2-3 Wochen

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Steven R. Pride
An Introduction to Continuum Physics

Adopting a unified mathematical framework, this textbook gives a comprehensive derivation of the rules of continuum physics, describing how the macroscopic response of matter emerges from the underlying d…

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Yui Tik Pang (Andrew)
Biomolecules' Conformational Changes Studied by Simulations and Enhanced Sampling

This thesis illuminates the critical roles biomolecules, from small molecules to proteins, play in cellular functionality, particularly highlighting their conformational changes in response to environment…

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Micro and Nanomanufacturing Volume II

This completely revised new edition offers a comprehensive treatment of micro and nanofabrication techniques and applies established and research laboratory manufacturing techniques to various materials. …

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Peter Hess
Bonding, Structure, and Performance of Two-Dimensional Materials

This book presents a wealth of results obtained by first-principles calculations, molecular dynamics simulations, and tight-binding modeling on two-dimensional covalent bonding and the resulting formation…

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Luisa Di Paola
Fundamentals of Molecular Bioengineering

This textbook covers the scientific basics of molecular bioengineering, a new field where technology meets biology and chemistry, and the fundamental knowledge required for students to understand molecula…

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Structure and Physics of Viruses

In the ten years since the publication of the first edition of this book, structural virology has undergone many important conceptual and technical advances. A technical revolution has allowed the determi…

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Supriya Goyal
Nuclear dynamics in Au-Au collisions

A semi-classical transport model, namely, quantum molecular dynamics (QMD) model, is employed for the theoretical study of nuclear dynamics in case of Au197 + Au197 collisions at different beam energies f…

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José Antonio Fornés
Quantum Processes in Biology

In recent years, extensive research on stochastic processes such as neuron networks, molecular motors, dynamics models, anomalous diffusion, and disordered media has led to the development of various meth…

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