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Antibiotics (Basel, Switzerland)|November 25, 2020
Can We Exploit β-Lactamases Intrinsic Dynamics for Designing More Effective Inhibitors?Eleonora Gianquinto, Donatella Tondi, Giulia D'Arrigo, et al.
Molecular Informatics|August 4, 2016
BioGPS: The Music for the Chemo- and Bioinformatics WalzerLydia Siragusa, Francesca Spyrakis, Laura Goracci, et al.
Biochimica Et Biophysica Acta|June 2, 2006
Allosteric communication between alpha and beta subunits of tryptophan synthase: modelling the open-closed transition of the alpha subunitFrancesca Spyrakis, Samanta Raboni, Pietro Cozzini, et al.
ACS Infectious Diseases|November 14, 2018
Ten Years with New Delhi Metallo-β-lactamase-1 (NDM-1): From Structural Insights to Inhibitor DesignPasquale Linciano, Laura Cendron, Eleonora Gianquinto, et al.
Drug Discovery Today|April 4, 2026
Antibacterial PROTACs: the road ahead for next-generation antibiotics?Andrea Milelli, Simone Raimondi, Somayeh Asgharpour, et al.
Current Pharmaceutical Design|November 23, 2012
Correct protonation states and relevant waters = better computational simulations?Francesca Spyrakis, Luca Dellafiora, Chenxiao Da, et al.
Journal of Chemical Information and Modeling|July 18, 2023
Molecular Dynamics and Machine Learning Give Insights on the Flexibility-Activity Relationships in Tyrosine KinomeSarmistha Majumdar, Francesco Di Palma, Francesca Spyrakis, et al.
Molecules (Basel, Switzerland)|April 3, 2021
Binding of Androgen- and Estrogen-Like Flavonoids to Their Cognate (Non)Nuclear Receptors: A Comparison by Computational PredictionGiulia D'Arrigo, Eleonora Gianquinto, Giulia Rossetti, et al.
Physical Chemistry Chemical Physics : PCCP|June 5, 2013
Ligand migration through hemeprotein cavities: insights from laser flash photolysis and molecular dynamics simulationsStefania Abbruzzetti, Francesca Spyrakis, Axel Bidon-Chanal, et al.
Frontiers in Oncology|November 24, 2025
Correction: PFOA biomonitoring and kidney cancer risk: a meta-analysis of serum levelsFrancesca Spyrakis, Gioele Antonio Tiburtini, Stefania Bruno, et al.
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