CIRIACO, Fulvio
CIRIACO, Fulvio
DIPARTIMENTO DI CHIMICA
A program for the solution of chemical equilibria among multiple phases
2017-01-01 Ciriaco, Fulvio; Trotta, Massimo; Milano, Francesco
A validation strategy for in silico generated aptamers
2018-01-01 Cataldo, R.; Ciriaco, F.; Alfinito, E.
Ab-initio investigation of unexpected aspects of hydroxylation of diketopiperazines by reaction with dioxiranes
2016-01-01 Annese, Cosimo; D'Accolti, Lucia; Fusco, Caterina; Ciriaco, Fulvio
Ab-initio structural study of dithiol adsorption on Au(111).
2008-01-01 Ciriaco, Fulvio; Laricchia, S; Cassidei, L; Mavelli, Fabio
Ab-initio structural study of dithiol adsorption on Au(111)
2008-01-01 Ciriaco, Fulvio; Laricchia, S; Cassidei, L; Mavelli, Fabio
Accelerating drug discovery by early protein drug target prediction based on a multi-fingerprint similarity search †
2019-01-01 Montaruli, M.; Alberga, D.; Ciriaco, F.; Trisciuzzi, D.; Tondo, A. R.; Mangiatordi, G. F.; Nicolotti, O.
Ag submonolayer structures on Pt(111) in conditions of thermodynamic equilibrium from simulation of He scattering experiments
2001-01-01 G., Petrella; L., Cassidei; Ciriaco, Fulvio
An In-Silico Pipeline for Rapid Screening of DNA Aptamers against Mycotoxins: The Case-Study of Fumonisin B1, Aflatoxin B1 and Ochratoxin A
2020-01-01 Ciriaco, Fulvio; De Leo, Vincenzo; Catucci, Lucia; Pascale, Michelangelo; Logrieco, Antonio F; Derosa, Maria C; De Girolamo, Annalisa
Azetidine-Borane Complexes: Synthesis, Reactivity and Stereoselective Functionalization
2018-01-01 Andresini, Michael; De Angelis, Sonia; Uricchio, Antonella; Visaggio, Angelica; Romanazzi, Giuseppe; Ciriaco, Fulvio; Corriero, Nicola; Degennaro, Leonardo; Luisi, Renzo
Benchmark calculations of density functionals for organothiol adsorption on gold surfaces
2013-01-01 Ciriaco, Fulvio; Mavelli, Fabio; Cassidei, L.
CIRCE: Web-Based Platform for the Prediction of Cannabinoid Receptor Ligands Using Explainable Machine Learning
2023-01-01 Gambacorta, Nicola; Ciriaco, Fulvio; Amoroso, Nicola; Altomare, Cosimo Damiano; Bajorath, Jürgen; Nicolotti, Orazio
Combined powder X-ray diffraction data and quantum-chemical calculations in EXPO2014
2017-01-01 Altomare, Angela; Ciriaco, Fulvio; Cuocci, Corrado; Falcicchio, Aurelia; Fanelli, Flavio
CUPID: A free drug discovery platform for the explainable multi-ion channel assessment of cardiotoxicity
2025-01-01 Gambacorta, Nicola; Mastrolorito, Fabrizio; Togo, Maria Vittoria; Amenduni, Vincenzo; Mele, Marco; Liantonio, Antonella; Mele, Antonietta; De Luca, Annamaria; Altomare, Cosimo Damiano; Belgiovine, Valentina; Tondo, Anna Rita; Cutropia, Francesca; Siragusa, Lydia; Amoroso, Nicola; Ciriaco, Fulvio; Imbrici, Paola; Trisciuzzi, Daniela; Nicolotti, Orazio
De Novo Drug Design of Targeted Chemical Libraries Based on Artificial Intelligence and Pair-Based Multiobjective Optimization
2020-01-01 Alberga, Domenico; Gambacorta, Nicola; Trisciuzzi, Daniela; Ciriaco, Fulvio; Amoroso, Nicola; Nicolotti, Orazio
Design and modelling of a photo-electrochemical transduction system based on solubilized photosynthetic reaction centres
2019-01-01 Milano, F.; Ciriaco, F.; Trotta, M.; Chirizzi, D.; De Leo, V.; Agostiano, A.; Valli, L.; Giotta, L.; Guascito, M. R.
Determination of Ag submonolayer structures on Pt(111) from simulation and data of He scattering experiments
2011-01-01 Ciriaco, Fulvio; Cassidei, L.
DFT study of 1,3-benzenedimethanethiol adsorption on Au(111)
2009-01-01 Laricchia, S; Ciriaco, Fulvio; Cassidei, L; Mavelli, Fabio
DFT study of 1,3-benzenedimethanethiol adsorption on Au(111)
2010-01-01 Laricchia, S; Ciriaco, Fulvio; Cassidei, L; Mavelli, Fabio
Disordered surfaces: A smoothed He-target scattering potential for metal atoms adsorbed on metal surfaces
1997-01-01 Petrella, G.; Cassidei, L.; Ciriaco, F.
DPD Simulations to investigate polymer nanocomposites morphology
2007-01-01 Bianchino, E; Piotto, S; Sciancalepore, C; Curri, M. L.; Agostiano, Angela; Striccoli, M; Ciriaco, Fulvio; Mavelli, Fabio
| Titolo | Data di pubblicazione | Autore(i) | File |
|---|---|---|---|
| A program for the solution of chemical equilibria among multiple phases | 1-gen-2017 | Ciriaco, Fulvio; Trotta, Massimo; Milano, Francesco | |
| A validation strategy for in silico generated aptamers | 1-gen-2018 | Cataldo, R.; Ciriaco, F.; Alfinito, E. | |
| Ab-initio investigation of unexpected aspects of hydroxylation of diketopiperazines by reaction with dioxiranes | 1-gen-2016 | Annese, Cosimo; D'Accolti, Lucia; Fusco, Caterina; Ciriaco, Fulvio | |
| Ab-initio structural study of dithiol adsorption on Au(111). | 1-gen-2008 | Ciriaco, Fulvio; Laricchia, S; Cassidei, L; Mavelli, Fabio | |
| Ab-initio structural study of dithiol adsorption on Au(111) | 1-gen-2008 | Ciriaco, Fulvio; Laricchia, S; Cassidei, L; Mavelli, Fabio | |
| Accelerating drug discovery by early protein drug target prediction based on a multi-fingerprint similarity search † | 1-gen-2019 | Montaruli, M.; Alberga, D.; Ciriaco, F.; Trisciuzzi, D.; Tondo, A. R.; Mangiatordi, G. F.; Nicolotti, O. | |
| Ag submonolayer structures on Pt(111) in conditions of thermodynamic equilibrium from simulation of He scattering experiments | 1-gen-2001 | G., Petrella; L., Cassidei; Ciriaco, Fulvio | |
| An In-Silico Pipeline for Rapid Screening of DNA Aptamers against Mycotoxins: The Case-Study of Fumonisin B1, Aflatoxin B1 and Ochratoxin A | 1-gen-2020 | Ciriaco, Fulvio; De Leo, Vincenzo; Catucci, Lucia; Pascale, Michelangelo; Logrieco, Antonio F; Derosa, Maria C; De Girolamo, Annalisa | |
| Azetidine-Borane Complexes: Synthesis, Reactivity and Stereoselective Functionalization | 1-gen-2018 | Andresini, Michael; De Angelis, Sonia; Uricchio, Antonella; Visaggio, Angelica; Romanazzi, Giuseppe; Ciriaco, Fulvio; Corriero, Nicola; Degennaro, Leonardo; Luisi, Renzo | |
| Benchmark calculations of density functionals for organothiol adsorption on gold surfaces | 1-gen-2013 | Ciriaco, Fulvio; Mavelli, Fabio; Cassidei, L. | |
| CIRCE: Web-Based Platform for the Prediction of Cannabinoid Receptor Ligands Using Explainable Machine Learning | 1-gen-2023 | Gambacorta, Nicola; Ciriaco, Fulvio; Amoroso, Nicola; Altomare, Cosimo Damiano; Bajorath, Jürgen; Nicolotti, Orazio | |
| Combined powder X-ray diffraction data and quantum-chemical calculations in EXPO2014 | 1-gen-2017 | Altomare, Angela; Ciriaco, Fulvio; Cuocci, Corrado; Falcicchio, Aurelia; Fanelli, Flavio | |
| CUPID: A free drug discovery platform for the explainable multi-ion channel assessment of cardiotoxicity | 1-gen-2025 | Gambacorta, Nicola; Mastrolorito, Fabrizio; Togo, Maria Vittoria; Amenduni, Vincenzo; Mele, Marco; Liantonio, Antonella; Mele, Antonietta; De Luca, Annamaria; Altomare, Cosimo Damiano; Belgiovine, Valentina; Tondo, Anna Rita; Cutropia, Francesca; Siragusa, Lydia; Amoroso, Nicola; Ciriaco, Fulvio; Imbrici, Paola; Trisciuzzi, Daniela; Nicolotti, Orazio | |
| De Novo Drug Design of Targeted Chemical Libraries Based on Artificial Intelligence and Pair-Based Multiobjective Optimization | 1-gen-2020 | Alberga, Domenico; Gambacorta, Nicola; Trisciuzzi, Daniela; Ciriaco, Fulvio; Amoroso, Nicola; Nicolotti, Orazio | |
| Design and modelling of a photo-electrochemical transduction system based on solubilized photosynthetic reaction centres | 1-gen-2019 | Milano, F.; Ciriaco, F.; Trotta, M.; Chirizzi, D.; De Leo, V.; Agostiano, A.; Valli, L.; Giotta, L.; Guascito, M. R. | |
| Determination of Ag submonolayer structures on Pt(111) from simulation and data of He scattering experiments | 1-gen-2011 | Ciriaco, Fulvio; Cassidei, L. | |
| DFT study of 1,3-benzenedimethanethiol adsorption on Au(111) | 1-gen-2009 | Laricchia, S; Ciriaco, Fulvio; Cassidei, L; Mavelli, Fabio | |
| DFT study of 1,3-benzenedimethanethiol adsorption on Au(111) | 1-gen-2010 | Laricchia, S; Ciriaco, Fulvio; Cassidei, L; Mavelli, Fabio | |
| Disordered surfaces: A smoothed He-target scattering potential for metal atoms adsorbed on metal surfaces | 1-gen-1997 | Petrella, G.; Cassidei, L.; Ciriaco, F. | |
| DPD Simulations to investigate polymer nanocomposites morphology | 1-gen-2007 | Bianchino, E; Piotto, S; Sciancalepore, C; Curri, M. L.; Agostiano, Angela; Striccoli, M; Ciriaco, Fulvio; Mavelli, Fabio |