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0000002869 18S 2SWS UE Exercise to Molecular Dynamics Simulations: from Principles to Application   Hilfe Logo

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Exercise to Molecular Dynamics Simulations: from Principles to Application 
0000002869
exercise
2
Summer semester 2018
Chair of Theoretical Biophysics (T38) - Biomolecular Dynamics (Prof. Zacharias)
(Contact information)
Details
Angaben zur Abhaltung
I Simulation methods
- MD basics (equations of motion, integrators etc.)
- MD in various ensembles
- Long-range interactions
- Free energy simulations
- Car-Parinello MD
- Non-equilibrium simulations
- Force fields
II Applications
- Water and aqeuous solutions
- Biomolecules
- Interfacial systems
no
  • German
  • English
Details
Für die Anmeldung zur Teilnahme müssen Sie sich in TUMonline als Studierende/r identifizieren.
Zusatzinformationen
D. Frenkel, B. Smit Understanding Molecular Simulation
M. P. Allen, D. J. Tildesley Computer Simulation of Liquids
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