Dr Sofia Oliveira
Current positions
Senior Research Fellow
School of Chemistry
Contact
Press and media
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Projects and supervisions
Research projects
Dynamical-nonequilibrium simulations: an emerging approach to study time-dependent structural changes in proteins
Principal Investigator
Managing organisational unit
School of ChemistryDates
01/07/2023 to 30/06/2026
Publications
Recent publications
10/01/2024Decrypting allostery in membrane-bound K-Ras4B using complementary in silico approaches based on unbiased molecular dynamics simulations
Journal of the American Chemical Society
Fluctuation relations to calculate protein redox potentials from molecular dynamics simulations
Journal of Chemical Theory and Computation
Signal Propagation in the ATPase Domain of Mycobacterium tuberculosis DNA Gyrase from Dynamical-Nonequilibrium Molecular Dynamics Simulations
Biochemistry
An expandable, modular de novo protein platform for precision redox engineering
Proceedings of the National Academy of Sciences of the United States of America
#COVIDisAirborne
International Journal of High Performance Computing Applications