Difference between revisions of "Fortgeschrittene Molekulardynamik II"
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Revision as of 20:00, 22 July 2009
<setdata> date=t.b.a. topic=Fortgeschrittene Molekulardynamik II: Überschreiten von Barrieren in der freien Energie tutor=Stefan Kesselheim </setdata>
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Literatur
-
Daan Frenkel, Berend Smit.
Understanding Molecular Simulation: From Algorithms to Applications.
Part of Computational Science, volume 1. Edition 2.
Academic Press, San Diego, 2002. ISBN: 978-0-12-267351-1.
[DOI]
- Chapter 7'
- Entry "sugina99a" not found!
Gliederungsvorschlag
- 1 Problemstellung
- 2 Umbrella Sampling
- 3 Replica Exchange Molecular Dynamics
- 4 Anwendungen