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Gabriele Cruciani is full professor of Organic Chemistry at the University of Perugia, Italy and is the director of the human Cytochrome Consortium Initiative (a consortium of seven pharmaceutical companies collaborating to address metabolism issues in predictive human metabolism). Cruciani is also a member of the technical scientific advisory board of several pharmaceutical companies.
He’s active in the field of ADME and computer-aided drug design, due to his over two decades of software production for data mining and drug discovery experience, focused on drug informatics,  cheminformatics, small-molecule and target informatics, and virtual screening. He obtained several support grants from pharmaceutical companies.



Prof. Gabriele Cruciani
Dipartimento di Chimica, Biologia e Biotecnologie
Via Elce di Sotto 8,
06123 Perugia (PG) ITALY

Phone: +39 075 585 5629

E-mail: gabri [AT] chemiome [DOT] chm [DOT] unipg [DOT] it
Website: www.chm.unipg.it/cheminf

Selected Publications:

  • “Structure–metabolism relationships in human- AOX: Chemical insights from a large database of aza-aromatic and amide compounds” Lepri, S.; Ceccarelli, M.; Milani, N.; et al. Proc Natl Acad Sci. 2017, 114, E3178–E3187. (link)
  • “Small molecule inhibitors of influenza A and B viruses that act by disrupting subunit interactions of the viral polymerase” Muratore, G.; Goracci, L.; Mercorelli, B.;  Foeglein,  A.; Digard,  P.; Cruciani, G.; Palù, G.; Loregian, A.; PNAS 2012, 109, 6247-6252. (link)
  • “Molecular interaction fields” Cruciani, G.; Mannhold, R.; Kubinyi, H.; Folkers, G.; Serie ED.S; WILEY-VCH WEINHEIM Vol. 27. (ISBN: 3527310878)

Permanent Members

paola bn2

Paola Belanzoni
(Associate Professor)
University of Perugia

leonardo bn

Leonardo Belpassi
(Research Scientist)
National Research Council

olivia bn

Olivia Bizzarri
National Research Council

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Stefano Crocchianti
(Research Scientist)
University of Perugia

Cruciani bn2

Gabriele Cruciani 
(Full Professor)
University of Perugia

filippo bn

Filippo De Angelis
(Senior Research Scientist)
National Research Council

noelia bn2

Noelia Faginas Lago
(Research Scientist)
University of Perugia

simona bn

Simona Fantacci
(Senior Research Scientist)
National Research Council

goracci bn

Laura Goracci
(Research Scientist)
University of Perugia

lagana bn2

Antonio Laganà
(Full Professor)

lombardi bn

Andrea Lombardi
(Research Scientist)
University of Perugia

edoardo bn2

Edoardo Mosconi
(Research Scientist)
National Research Council

nunzi bn

Francesca Nunzi
(Research Scientist)
University of Perugia

tarantelli bn2

Francesco Tarantelli
(Full Professor)
University of Perugia

sara bn2

Sara Tortorella
(Research Scientist)
Molecular Horizon

vitillaro bn

Giuseppe Vitillaro
(Senior Technologist)
National Research Council


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April 23, 2018 (3,15 pm)

Seminars, Dr. Sergei Manzhos
"Computational materials modelling and design for next generation solar cell & metal-ion battery technologies" flier

July 2 - 5, 2018

18th International Conference on Computational Science and Its Applications (ICCSA 2018).
Workshop: Theoretical and Computational Chemistry and its Applications (TCCA).
Paper submission deadline extended to March 15, 2018

3-29 Sept 2018

Intensive Course TCCM Master in Perugia, Italy.

30 Sept – 2 Oct 2018

4th International Conference on Perovskite Solar Cells and Optoelectronics (PSCO-2018) in Lausanne, Switzerland.