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Methods in Molecular Biology (Clifton, N.J.)|December 21, 2011
Using metadynamics and path collective variables to study ligand binding and induced conformational transitionsNeva Bešker, Francesco L Gervasio
Journal of Biomolecular Structure & Dynamics|October 16, 2013
Molecular mechanisms of activation in CDK2Neva Bešker, Andrea Amadei, Marco D'Abramo
The Journal of Physical Chemistry. B|January 23, 2016
Molecular Packing in Langmuir Monolayers Composed of a Phosphatidylcholine and a Pyrene LipidDenise Gradella Villalva, Marco Diociaiuti, Luisa Giansanti, et al.
International Journal of Molecular Sciences|August 1, 2020
Computational Studies of SARS-CoV-2 3CLpro: Insights from MD SimulationsAlessandro Grottesi, Neva Bešker, Andrew Emerson, et al.
Colloids and Surfaces. B, Biointerfaces|January 12, 2016
Kinetics and mechanistic study of competitive inhibition of thymidine phosphorylase by 5-fluoruracil derivativesManuela Petaccia, Patrizia Gentili, Neva Bešker, et al.
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