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Marianna Stampolaki
ORCID
Publication Activity (10 Years)
Years Active: 2023-2023
Publications (10 Years): 1
Top Topics
Parameter Estimation
Free Energy
Top Venues
J. Comput. Aided Mol. Des.
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Publications
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Marianna Stampolaki
,
Ioannis Stylianakis
,
Helen I. Zgurskaya
,
Antonios Kolocouris
Study of SQ109 analogs binding to mycobacterium MmpL3 transporter using MD simulations and alchemical relative binding free energy calculations.
J. Comput. Aided Mol. Des.
37 (5) (2023)