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Current Medicinal Chemistry|December 18, 2009
Computational analysis of Human Immunodeficiency Virus (HIV) Type-1 reverse transcriptase crystallographic models based on significant conserved residues found in Highly Active Antiretroviral Therapy (HAART)-treated patientsStefano Alcaro, Anna Artese, Francesca Ceccherini-Silberstein, et al.Journal of Chemical Information and Modeling|June 23, 2009
Molecular dynamics and free energy studies on the wild-type and mutated HIV-1 protease complexed with four approved drugs: mechanism of binding and drug resistanceStefano Alcaro, Anna Artese, Francesca Ceccherini-Silberstein, et al.Bioorganic & Medicinal Chemistry Letters|April 13, 2010
Chromone-2- and -3-carboxylic acids inhibit differently monoamine oxidases A and BStefano Alcaro, Alexandra Gaspar, Francesco Ortuso, et al.Chemical Biology & Drug Design|May 2, 2017
Molecular recognition of a carboxy pyridostatin toward G-quadruplex structures: Why does it prefer RNA?Roberta Rocca, Carmine Talarico, Federica Moraca, et al.Future Medicinal Chemistry|March 29, 2022
Identification of SET/EED dual binders as innovative PRC2 inhibitorsRaffaella Catalano, Annalisa Maruca, Roberta Rocca, et al.Journal of Chemical Information and Modeling|September 14, 2012
GRID-based three-dimensional pharmacophores II: PharmBench, a benchmark data set for evaluating pharmacophore elucidation methodsSimon Cross, Francesco Ortuso, Massimo Baroni, et al.NPJ Systems Biology and Applications|September 25, 2025
Integrative structural profiling and ligand optimisation across the transthyretin mutational landscapeUgo Lomoio, Valentina Carbonari, Federico Manuel Giorgi, et al.Bioorganic & Medicinal Chemistry Letters|June 1, 2002
Preparation, characterization, molecular modeling and in vitro activity of paclitaxel-cyclodextrin complexesStefano Alcaro, Cinzia Anna Ventura, Donatella Paolino, et al.Journal of Medicinal Chemistry|March 17, 2011
Homoisoflavonoids: natural scaffolds with potent and selective monoamine oxidase-B inhibition propertiesNicoletta Desideri, Adriana Bolasco, Rossella Fioravanti, et al.Journal of Medicinal Chemistry|September 16, 2005
Molecular modeling, synthesis, and preliminary biological evaluation of glutathione-S-transferase inhibitors as potential therapeutic agentsAntonio Procopio, Stefano Alcaro, Sante Cundari, et al.Pageof 13