Rocco Buccheri

5PUBLICATIONS
12CO-AUTHORS
Cheminformatics and quantitative structure-activity relationshipsPharmacogenomicsNatural products and bioactive compoundsProcess control and simulation
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Publications (5)

|Aug 27, 2026
Beyond the Score: Fixed-Budget Benchmarking of Virtual Screening Integration Strategies for Decision-Centric Drug Discovery.

|May 13, 2026
Structure-Guided Repurposing of Approved Drugs Identifies Aprepitant and Mavorixafor as Putative δ-Opioid Receptor Agonist Candidates.

|Oct 16, 2025
Synthesis and Biological Profile of Omaveloxolone: The Cornerstone for Friedreich Ataxia Treatment.

Massimiliano Cordaro, Giulia Neri, Shoeb Anwar Mohammed Khawja Ansari

|Aug 28, 2025
High-Throughput, High-Quality: Benchmarking GNINA and AutoDock Vina for Precision Virtual Screening Workflow.

Rocco Buccheri, Antonio Rescifina

|Jan 25, 2025
Enhancing HDAC Inhibitor Screening: Addressing Zinc Parameterization and Ligand Protonation in Docking Studies.

Rocco Buccheri, Alessandro Coco, Lorella Pasquinucci

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Frequent Collaborators

4 joint publications

Antonio Rescifina

2 joint publications

Alessandro Coco

2 joint publications

Lorella Pasquinucci

1 joint publications

Emanuele Amata