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<strong>The Soft Matter and Interfaces group</strong> | <strong>The Soft Matter and Interfaces group</strong> | ||
''' On-going effort to tell you how me (Ana Vila Verde) and my research group spend our time. ''' | |||
<gallery> | <gallery> | ||
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'''Postal address''' | '''Postal address''' | ||
University of Duisburg-Essen | University of Duisburg-Essen, | ||
Faculty of Physics | Faculty of Physics (AG Wolf), | ||
Lotharstr. 1 | Lotharstr. 1, | ||
47057 Duisburg | 47057 Duisburg, | ||
Germany | Germany | ||
'''Where I do my thinking:''' building MG, office 383 | '''Where I do my thinking:''' building MG, office 383 | ||
'''Email:''' ana.araujo-vila-verde@uni-due.de | |||
We use particle-based simulation methods to investigate the structure and dynamics of soft matter and of interfaces, both biological and inorganic. We have currently these areas of interest: fluorinated proteins, water and ions, and mechanical properties of proteins. We use mainly classical molecular dynamics or Monte Carlo methods and a variety of levels of description of matter (fixed-charge or polarizable all-atom, coarse-grained), with emphasis on advanced simulation techniques to enhance sampling of phase space thus allowing the calculation of thermodynamic observables such as relative free energies. | We use particle-based simulation methods to investigate the structure and dynamics of soft matter and of interfaces, both biological and inorganic. We have currently these areas of interest: fluorinated proteins, water and ions, and mechanical properties of proteins. We use mainly classical molecular dynamics or Monte Carlo methods and a variety of levels of description of matter (fixed-charge or polarizable all-atom, coarse-grained), with emphasis on advanced simulation techniques to enhance sampling of phase space thus allowing the calculation of thermodynamic observables such as relative free energies. | ||
Revision as of 09:56, 23 February 2021
The Soft Matter and Interfaces group
On-going effort to tell you how me (Ana Vila Verde) and my research group spend our time.
Dr. Ana Vila Verde (she)
WOS ResearcherID: H-7805-2013 ORCID: 0000-0003-0337-3972
Postal address University of Duisburg-Essen, Faculty of Physics (AG Wolf), Lotharstr. 1, 47057 Duisburg, Germany
Where I do my thinking: building MG, office 383
Email: ana.araujo-vila-verde@uni-due.de
We use particle-based simulation methods to investigate the structure and dynamics of soft matter and of interfaces, both biological and inorganic. We have currently these areas of interest: fluorinated proteins, water and ions, and mechanical properties of proteins. We use mainly classical molecular dynamics or Monte Carlo methods and a variety of levels of description of matter (fixed-charge or polarizable all-atom, coarse-grained), with emphasis on advanced simulation techniques to enhance sampling of phase space thus allowing the calculation of thermodynamic observables such as relative free energies.
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