Description

Book Synopsis

Until the late 20th century, computational studies of biomolecules and nanomaterials had considered the two subjects separately. A thorough presentation of state-of-the-art simulations for studying the nanoscale behavior of materials, Simulations in Nanobiotechnology discusses computational simulations of biomolecules and nanomaterials together. The book gives readers insight into not only the fundamentals of simulation-based characterizations in nanobiotechnology, but also in how to approach new and interesting problems in nanobiotechnology using basic theoretical and computational frameworks.

Presenting the simulation-based nanoscale characterizations in biological science, Part 1:

  • Describes recent efforts in MD simulation-based characterization and CG modeling of DNA and protein transport dynamics in the nanopore and nanochannel
  • Presents recent advances made in continuum mechanics-based modeling of membrane proteins

    Table of Contents

    Introduction. Molecular Dynamics of Protein Translocation. Coarse-Grained Modeling of DNA Translocation through Nanopore. Atomistic Simulation of Auger Process in Nanoparticle-Based Theragnostics. Coarse-Grained Modeling of CNT-DNA Interaction. Molecular Dynamics of CNT-DNA Interaction. Modeling of CNT-DNA Hybrid Complex. Coarse-Grained Modeling of Nano-Cantilever-Based DNA Detection. Coarse-Grained Modeling of Micro- or Nano-Cantilever Sensors for Atomistic Detection. Continuum Modeling of CNT -Based Molecular Recognitions. Multi-Scale Modeling of Nanowire Resonator Sensors. Cauchy-Born Rule for Modeling Graphene Sheet. Coarse-Grained Modeling of Single-Molecule Experiments. Coarse-Grained Modeling of Protein Dynamics. Molecular Dynamics Simulation of Protein Mechanics. Continuum Modeling of Large Protein Complex. Modeling of Biomimetic Adhesive.

Simulations in Nanobiotechnology

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    A Hardback by Kilho Eom

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      Book details

      Publisher CRC Press Inc
      Published 19 October 2011
      ISBN-13 9781439835043
      978-1439835043
      ISBN-10 1439835047
      Also in:
      Environmental science, engineering and technology Materials science Nanotechnology

      Description

      Book Synopsis

      Until the late 20th century, computational studies of biomolecules and nanomaterials had considered the two subjects separately. A thorough presentation of state-of-the-art simulations for studying the nanoscale behavior of materials, Simulations in Nanobiotechnology discusses computational simulations of biomolecules and nanomaterials together. The book gives readers insight into not only the fundamentals of simulation-based characterizations in nanobiotechnology, but also in how to approach new and interesting problems in nanobiotechnology using basic theoretical and computational frameworks.

      Presenting the simulation-based nanoscale characterizations in biological science, Part 1:

      • Describes recent efforts in MD simulation-based characterization and CG modeling of DNA and protein transport dynamics in the nanopore and nanochannel
      • Presents recent advances made in continuum mechanics-based modeling of membrane proteins

        Table of Contents

        Introduction. Molecular Dynamics of Protein Translocation. Coarse-Grained Modeling of DNA Translocation through Nanopore. Atomistic Simulation of Auger Process in Nanoparticle-Based Theragnostics. Coarse-Grained Modeling of CNT-DNA Interaction. Molecular Dynamics of CNT-DNA Interaction. Modeling of CNT-DNA Hybrid Complex. Coarse-Grained Modeling of Nano-Cantilever-Based DNA Detection. Coarse-Grained Modeling of Micro- or Nano-Cantilever Sensors for Atomistic Detection. Continuum Modeling of CNT -Based Molecular Recognitions. Multi-Scale Modeling of Nanowire Resonator Sensors. Cauchy-Born Rule for Modeling Graphene Sheet. Coarse-Grained Modeling of Single-Molecule Experiments. Coarse-Grained Modeling of Protein Dynamics. Molecular Dynamics Simulation of Protein Mechanics. Continuum Modeling of Large Protein Complex. Modeling of Biomimetic Adhesive.

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