Molecular docking via weighted subgraph isomorphism on quantum annealers
Published by
Quantum Science and Technology
Summary
journal-article
About
Computational physicist, mathematical engineer & MBA graduate upgrading EXSCALATE Platform toward automated, tunable, portable High Throughput Virtual Screening campaigns. Background in solid state physics and nanotechnology with hands-on experience in R&D of top tier biotech/pharma and aerospace/defence companies. Grateful to have explored a wide range of topics in research & technology from both an academic and industrial lens, including computer aided drug discovery, high performance and quantum computing, machine learning and hardware/software development. Driven by curiosity, challenge and a desire to make this World a better place.
Work
Istituto Italiano di Tecnologia
|Affiliated Researcher
Italy
→
University of L'Aquila
|Research Fellow in Computational Physics
Italy
→
Dompé farmaceutici SpA
|Drug Discovery Platform Specialist
Italy
→
Dompé farmaceutici SpA
|New Technologies & Innovation Specialist
Italy
→
Dompé farmaceutici SpA
|New Technologies & Innovation Officer
Italy
→
Dompé farmaceutici SpA
|Digital Engineering Officer
Italy
→
Thales Alenia Space
|R&D Project Engineer
Italy
→
Thales Alenia Space
|Equipment Enabling Technologies
Italy
→
CNH Industrial (Italy)
|Associate Project Manager
Italy
→
H-Farm SpA
|Data Scientist
Italy
→
STMicroelectronics Srl Sede di Cornaredo
|Hardware Design Engineer
Italy
→
Eni
|Researcher
Italy
→
Education
Università degli Studi dell'Aquila Dipartimento di Scienze Fisiche e Chimiche
Italy
→
Ph.D. Computational Physics
Collège des Ingénieurs
France
→
MBA
Università degli Studi dell'Aquila
Italy
→
M.Sc.
Università degli Studi dell'Aquila
Italy
→
B.Sc.
Publications
Addressing docking pose selection with structure-based deep learning: Recent advances, challenges and opportunities
Published by
Computational and Structural Biotechnology Journal
Summary
journal-article
An LSTM-enhanced surrogate model to simulate the dynamics of particle-laden fluid systems
Published by
Computers & Fluids
Summary
journal-article
LIGATE - LIgand Generator and portable drug discovery platform AT Exascale
Summary
conference-paper
A non-intrusive data-driven reduced order model for parametrized CFD-DEM numerical simulations
Published by
Journal of Computational Physics
Summary
journal-article
A coupled CFD-DEM model for OKi Task production on Innojet V1000 granulator
Published by
ECCOMAS Math 2 Product, IS11 - Advanced computational mechanics in real-world applications
Summary
conference-poster
A Deep Learning Approach to Optimize Recombinant Protein Production in Escherichia coli Fermentations
Published by
Fermentation
Summary
journal-article
A Deep Learning Approach to Optimize Recombinant Protein Production in <i>Escherichia coli</i> Fermentations
Published by
Fermentation
Summary
journal-article
Tunable and Portable Extreme-Scale Drug Discovery Platform at Exascale
Summary
conference-paper
Deep Learning ligand pose predictor in High Throughput Virtual Screening
Published by
BIG DATA VALUE FORUM
Summary
conference-poster