Author
U. Rothlisberger
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Biology Disciplines
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2020-2022 · peak 1/yrCo-Author Collaboration Network
9 top collaborators · 22 mutual co-author linksFocal author (center)Selected co-authorORCID co-authorUnlinked name
Curved chords = mutual co-authorship2 papers
Recent·Most cited
On the accuracy of molecular simulation-based predictions of koff values: a Metadynamics study
R. Capelli, W. Lyu, V. Bolnykh, S. Meloni, J. M. H. Olsen, U. Rothlisberger, M. Parrinello, P. Carloni
This paper evaluates the accuracy of molecular simulations in predicting koff values for drug unbinding using metadynamics and QM/MM methods, finding discrepancies due to force field limitations.
The Journal of Physical Chemistry Letters · Jul 16, 2020Peer-reviewedBiophysics