Ursula Roethlisberger, Ph.D. - Publications
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 SoWebsite:
https://lcbc.epfl.chYear | Citation | Score | |||
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2019 | Casalino L, Palermo G, Spinello A, Roethlisberger U, Magistrato A. Pre-mRNA Splicing: The Gene Maturation Symphony of the Intron Lariat Spliceosome Revealed by Molecular Dynamics Simulations Biophysical Journal. 116: 299a. DOI: 10.1016/J.Bpj.2018.11.1619 | 0.55 | |||
2017 | Delemotte L, van Keulen S, Roethlisberger U, Gianti E, Carnevale V, Klein ML. Does Proton Conduction in the Voltage-Gated Proton Channel hH V 1 Involve Grotthus Hopping via Acidic Residues? Biophysical Journal. 112: 163a-164a. DOI: 10.1016/J.Bpj.2016.11.899 | 0.501 | |||
2005 | Beni Z, Guidoni L, Laurenczy G, Roethlisberger U, Roulet R. Experimental and theoretical study of intramolecular exchange in Ir2Rh2(CO)12 and Ir4(CO)11(micro-SO2). Dalton Transactions (Cambridge, England : 2003). 310-4. PMID 15616719 DOI: 10.1039/B415147J | 0.503 | |||
2003 | Magistrato A, Togni A, Roethlisberger U, Woo TK. Enantioselective Hydrosilylation by Chiral Pd Based Homogeneous Catalysts with First-Principles and Combined QM/MM Molecular Dynamics Simulations Cheminform. 34. DOI: 10.1002/chin.200345275 | 0.569 | |||
1995 | Roethlisberger U, Klein ML. 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. DOI: 10.1021/Ja00106A005 | 0.505 | |||
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