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Ursula Roethlisberger, Ph.D.

Affiliations: 
1996-2002 Eidgenössische Technische Hochschule Zürich, Zürich, ZH, Switzerland 
 2002- ISIC École Polytechnique Fédérale de Lausanne, Lausanne, Switzerland 
Area:
Development of Hybrid QM/MM Methods for Combined Quantum/Classical Car-Parrinello Simulations, Development of Long-Time Scale Techniques for Ab initio MD Simulations, In situ Simulations of Chemical Reactions and Photoactive systems in Gas Phase and in So
Website:
https://lcbc.epfl.ch
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Parents

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Wanda Andreoni grad student IBM Research Laboratory - Rüschlikon
Ernst Schumacher grad student Bern University
Michael L. Klein post-doc 1992-1995 Penn
Michele Parrinello post-doc 1995-1996 Max-Planck-Institute for Solid State Physics

Children

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Alessandra Magistrato grad student SISSA, Trieste
Enrico Marko Tapavicza grad student EPFL
O. Anatole von Lilienfeld-Toal grad student 2002-2005 University of Basel
Lucie Delemotte post-doc KTH Royal Institute of Technology
Leonardo Guidoni post-doc Università dell'Aquila
Alessandro Laio post-doc 2000-2001 SISSA, Trieste
Giulia Palermo post-doc 2013-2015 UC Riverside
Jógvan Magnus Haugaard Olsen post-doc 2014-2016 EPFL

Collaborators

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Publications

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Casalino L, Palermo G, Spinello A, et al. (2019) Pre-mRNA Splicing: The Gene Maturation Symphony of the Intron Lariat Spliceosome Revealed by Molecular Dynamics Simulations Biophysical Journal. 116: 299a
Delemotte L, van Keulen S, Roethlisberger U, et al. (2017) Does Proton Conduction in the Voltage-Gated Proton Channel hH V 1 Involve Grotthus Hopping via Acidic Residues? Biophysical Journal. 112: 163a-164a
Beni Z, Guidoni L, Laurenczy G, et al. (2005) Experimental and theoretical study of intramolecular exchange in Ir2Rh2(CO)12 and Ir4(CO)11(micro-SO2). Dalton Transactions (Cambridge, England : 2003). 310-4
Magistrato A, Togni A, Roethlisberger U, et al. (2003) Enantioselective Hydrosilylation by Chiral Pd Based Homogeneous Catalysts with First-Principles and Combined QM/MM Molecular Dynamics Simulations Cheminform. 34
Roethlisberger U, Klein ML. (1995) Ab Initio Molecular Dynamics Investigation of Singlet C2H2Li2: Determination of the Ground State Structure and Observation of LiH Intermediates Journal of the American Chemical Society. 117: 42-48
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