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Scientific topics: Computational chemistry

and Authors: Simon Bray

8 materials found
  • e-learning

    Protein-ligand docking

    •• Intermediate
    Computational chemistry Computational chemistry
  • e-learning

    Protein target prediction of a bioactive ligand with Align-it and ePharmaLib

    •• Intermediate
    Computational chemistry Computational chemistry
  • e-learning

    Running molecular dynamics simulations using GROMACS

    •• Intermediate
    Computational chemistry Computational chemistry
  • e-learning

    Virtual screening of the SARS-CoV-2 main protease with rxDock and pose scoring

    •• Intermediate
    Computational chemistry Computational chemistry covid19 one-health
  • e-learning

    High Throughput Molecular Dynamics and Analysis

    ••• Advanced
    Computational chemistry Computational chemistry
  • e-learning

    Analysis of molecular dynamics simulations

    •• Intermediate
    Computational chemistry Computational chemistry
  • e-learning

    Running molecular dynamics simulations using NAMD

    •• Intermediate
    Computational chemistry Computational chemistry
  • e-learning

    Setting up molecular systems

    •• Intermediate
    Computational chemistry Computational chemistry
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