21541a        
        
          Lecture        
      
      SoSe 13: Computer simulation of biomolecules
Ernst Walter Knapp
Additional information / Pre-requisites
      Vorbesprechung: 11.4., 14 Uhr, Takustr. 3, 33.03          
  Comments
        1. Inhalt (Content): Introduction: Building principles of biological macromelecules, dynamics of biomolecules Theoretical basis: Interactions of molecules, statistical mechanics, equation of motion Special techniques and applications: Saving CPU-time, energy minimization, normal modes, computation of electrostatic energies, computation of free energies.  2. Literatur: Andrew Leach, Molecular Modeling, Principles and Applications Wesley Longman 1996.  3. Remarks: The lecture is suitable for students of biochemistry, chemistry, physics and mathematics after the bachelor. It provides an introduction and is required to attend the two-week exercise 21 541 b with work stations. It yields the theoretical basis for modeling and computer simulation of biological macromolecules.        close
    
  