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CAM-D PLC employs computer simulations in research projects provided by the chemical industry.

  • Mesoscopic simulations (Dissipative Particle Dynamics)
  • QSAR/QSPR : Structure-Property-relations
  • Molecular dynamics and -mechanics simulations employing forcefields
  • Quantum mechanical calculations (ab initio, DFT (Density Functional Theory), semi-empirical)
  • Docking simulations investigating the interaction between proteins and active pharmaceutical ingredients
  • Methods to analyze structure and behaviour of metals, organic compounds and biopolymers

One core area is the development and application of new mesoscopic simulation techniques to calculate and predict complex phase diagrams of surfactant/water- or surfactant/oil-systems as well as the characterization of the adsorbing behaviour of polymers.

 

 

 


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