Molecular Modelling

Molecular modelling has become a valued and vital tool to medicinal chemists in the drug design process. Molecular modelling defines the generation, manipulation or illustration of three-D structures of molecules and linked to physico-chemical properties. It involves a range of high-tech methods based on theoretical chemistry methods and experimental data to foresee molecular and biological properties. Molecular modelling is used to simulate the molecular movements in chemical or biological structures.

 

  • Structural Modelling
  • Homology Modelling
  • Molecular Dynamics
  • Molecular Docking

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