Theses

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Thesis P. H. Hünenberger

Philippe Hünenberger
Molecular dynamics simulations using empirical force fields:
Principles and applications to selected systems of chemical and biochemical interest,
Thesis No 12052, ETH Zürich, February 1997.
Accepted on the recommendation of Prof. Dr. W.F. van Gunsteren, examiner, and Prof. Dr. R.R. Ernst, co-examiner
In view of its outstanding quality, this thesis was awarded the ETH silver medal.
(full text pdf in ETHZ e-collection)

Theses of the group

Ulf Börjesson (defense on 25.2.2004)
Electrostatic interactions in computer simulations of biomolecular systems.
(abstract pdf in ETHZ e-collection)

Mika Kastenholz (defense on 16.11.2005)
Electrostatic interactions in computer simulations of (bio-)molecular systems.
In view of its outstanding quality, Mika's thesis was awarded the ETH silver medal.
(abstract pdf in ETHZ e-collection)

Tim Heinz (defense on 26.4.2006)
Computer simulation of molecular systems: New algorithms and selected applications.
(abstract pdf in ETHZ e-collection)

Vincent Kräutler (defense on 7.6.2006)
Classical molecular dynamics simulation: Contributions to methodology development and applications to biomolecular systems.
(full text pdf in ETHZ e-collection)

Lovorka Perić-Hassler (defense on 19.8.2009)
Computer simulations of carbohydrates.
(full text pdf in ETHZ e-collection)

Maria Reif (defense on 15.12.2009)
Single-ion solvation properties using atomistic simulation.
In view of its outstanding quality, Maria's thesis was awarded the ETH silver medal.
(abstract pdf in ETHZ e-collection)

Halvor Hansen (defense on 23.6.2010)
Enhanced conformational sampling in molecular dynamics simulations.
(abstract pdf in ETHZ e-collection)

Monika Laner (defense on 9.4.2014)
Phase and phase-transition properties of mono- and diglyceride lipid bilayers investigated using molecular dynamics simulations.
(full text pdf in ETHZ e-collection)

Noah Bieler (defense on 25.2.2015)
Configurational and alchemical free-energy calculations using molecular dynamics simulations.
(abstract pdf in ETHZ e-collection)

Alice Lonardi (defense on 24.2.2016)
Solvent properties and their influence on carbohydrate conformation investigated using molecular dynamics simulations.
(full text pdf in ETHZ e-collection)

Pascal Merz (defense on 15.6.2016)
Computer simulation of liquids: Force-field development, property calculation, and sampling from artificial ensembles.
(not yet available in ETHZ e-collection)

 
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